id stringlengths 2 115 | lastModified stringlengths 24 24 | tags list | author stringlengths 2 42 ⌀ | description stringlengths 0 6.67k ⌀ | citation stringlengths 0 10.7k ⌀ | likes int64 0 3.66k | downloads int64 0 8.89M | created timestamp[us] | card stringlengths 11 977k | card_len int64 11 977k | embeddings list |
|---|---|---|---|---|---|---|---|---|---|---|---|
umarigan/turkiye_finance_qa | 2023-10-18T16:04:56.000Z | [
"task_categories:question-answering",
"size_categories:n<1K",
"language:tr",
"finance",
"region:us"
] | umarigan | null | null | 4 | 4 | 2023-10-18T15:38:28 | ---
dataset_info:
features:
- name: soru
dtype: string
- name: cevap
dtype: string
- name: __index_level_0__
dtype: int64
splits:
- name: train
num_bytes: 171936
num_examples: 428
download_size: 82421
dataset_size: 171936
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
task_categories:
- question-answering
language:
- tr
tags:
- finance
pretty_name: Finance
size_categories:
- n<1K
---
# Dataset Card for "turkiye_finance_qa"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 634 | [
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ceia-nlp/arc-portuguese | 2023-10-18T16:11:04.000Z | [
"region:us"
] | ceia-nlp | null | null | 0 | 4 | 2023-10-18T16:10:42 | ---
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
- split: test
path: data/test-*
- split: validation
path: data/validation-*
dataset_info:
features:
- name: id
dtype: string
- name: question
sequence: string
- name: choices
sequence:
- name: text
dtype: string
- name: label
dtype: string
- name: answerKey
dtype: string
splits:
- name: train
num_bytes: 370596
num_examples: 1119
- name: test
num_bytes: 399448
num_examples: 1172
- name: validation
num_bytes: 102919
num_examples: 299
download_size: 477678
dataset_size: 872963
---
# Dataset Card for "arc-portuguese"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 835 | [
[
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... |
ICILS/isco_esco_occupations_taxonomy | 2023-10-19T11:06:40.000Z | [
"task_categories:text-classification",
"task_ids:multi-class-classification",
"region:us"
] | ICILS | ISCO ESCO Occupations Taxonomy Dataset (IEOTD) is a hierarhical taxonomy dataset, consisting of occupation groups from ISCO, occupations from ESCO and definitions. | TBA | 0 | 4 | 2023-10-18T20:04:58 | ---
# For reference on dataset card metadata, see the spec: https://github.com/huggingface/hub-docs/blob/main/datasetcard.md?plain=1
# Doc / guide: https://huggingface.co/docs/hub/datasets-cards
task_categories:
- text-classification
task_ids:
- multi-class-classification
pretty_name: ISCO-ESCO Occupations Taxonomy
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splits:
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num_bytes: 248076
num_examples: 7018
- name: validation
num_bytes: 248076
num_examples: 7018
download_size: 458547
dataset_size: 496152
- config_name: isco_taxonomy
features:
- name: text
dtype: string
- name: labels
dtype:
class_label:
names:
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splits:
- name: train
num_bytes: 1422420
num_examples: 3017
- name: validation
num_bytes: 1422420
num_examples: 3017
download_size: 8654054
dataset_size: 2844840
train-eval-index:
- config: isco_occupations
task: text-classification
task_id: multi-class-classification
splits:
train_split: train
eval_split: validation
col_mapping:
text: text
label: labels
metrics:
- type: accuracy
name: Accuracy
---
# Dataset Card for {{ pretty_name | default("Dataset Name", true) }}
<!-- Provide a quick summary of the dataset. -->
{{ dataset_summary | default("", true) }}
## Dataset Details
### Dataset Description
<!-- Provide a longer summary of what this dataset is. -->
{{ dataset_description | default("", true) }}
- **Curated by:** {{ curators | default("[More Information Needed]", true)}}
- **Funded by [optional]:** {{ funded_by | default("[More Information Needed]", true)}}
- **Shared by [optional]:** {{ shared_by | default("[More Information Needed]", true)}}
- **Language(s) (NLP):** {{ language | default("[More Information Needed]", true)}}
- **License:** {{ license | default("[More Information Needed]", true)}}
### Dataset Sources [optional]
<!-- Provide the basic links for the dataset. -->
- **Repository:** {{ repo | default("[More Information Needed]", true)}}
- **Paper [optional]:** {{ paper | default("[More Information Needed]", true)}}
- **Demo [optional]:** {{ demo | default("[More Information Needed]", true)}}
## Uses
<!-- Address questions around how the dataset is intended to be used. -->
### Direct Use
<!-- This section describes suitable use cases for the dataset. -->
{{ direct_use | default("[More Information Needed]", true)}}
### Out-of-Scope Use
<!-- This section addresses misuse, malicious use, and uses that the dataset will not work well for. -->
{{ out_of_scope_use | default("[More Information Needed]", true)}}
## Dataset Structure
<!-- This section provides a description of the dataset fields, and additional information about the dataset structure such as criteria used to create the splits, relationships between data points, etc. -->
{{ dataset_structure | default("[More Information Needed]", true)}}
## Dataset Creation
### Curation Rationale
<!-- Motivation for the creation of this dataset. -->
{{ curation_rationale_section | default("[More Information Needed]", true)}}
### Source Data
<!-- This section describes the source data (e.g. news text and headlines, social media posts, translated sentences, ...). -->
#### Data Collection and Processing
<!-- This section describes the data collection and processing process such as data selection criteria, filtering and normalization methods, tools and libraries used, etc. -->
{{ data_collection_and_processing_section | default("[More Information Needed]", true)}}
#### Who are the source data producers?
<!-- This section describes the people or systems who originally created the data. It should also include self-reported demographic or identity information for the source data creators if this information is available. -->
{{ source_data_producers_section | default("[More Information Needed]", true)}}
### Annotations [optional]
<!-- If the dataset contains annotations which are not part of the initial data collection, use this section to describe them. -->
#### Annotation process
<!-- This section describes the annotation process such as annotation tools used in the process, the amount of data annotated, annotation guidelines provided to the annotators, interannotator statistics, annotation validation, etc. -->
{{ annotation_process_section | default("[More Information Needed]", true)}}
#### Who are the annotators?
<!-- This section describes the people or systems who created the annotations. -->
{{ who_are_annotators_section | default("[More Information Needed]", true)}}
#### Personal and Sensitive Information
<!-- State whether the dataset contains data that might be considered personal, sensitive, or private (e.g., data that reveals addresses, uniquely identifiable names or aliases, racial or ethnic origins, sexual orientations, religious beliefs, political opinions, financial or health data, etc.). If efforts were made to anonymize the data, describe the anonymization process. -->
{{ personal_and_sensitive_information | default("[More Information Needed]", true)}}
## Bias, Risks, and Limitations
<!-- This section is meant to convey both technical and sociotechnical limitations. -->
{{ bias_risks_limitations | default("[More Information Needed]", true)}}
### Recommendations
<!-- This section is meant to convey recommendations with respect to the bias, risk, and technical limitations. -->
{{ bias_recommendations | default("Users should be made aware of the risks, biases and limitations of the dataset. More information needed for further recommendations.", true)}}
## Citation [optional]
<!-- If there is a paper or blog post introducing the dataset, the APA and Bibtex information for that should go in this section. -->
**BibTeX:**
{{ citation_bibtex | default("[More Information Needed]", true)}}
**APA:**
{{ citation_apa | default("[More Information Needed]", true)}}
## Glossary [optional]
<!-- If relevant, include terms and calculations in this section that can help readers understand the dataset or dataset card. -->
{{ glossary | default("[More Information Needed]", true)}}
## More Information [optional]
{{ more_information | default("[More Information Needed]", true)}}
## Dataset Card Authors [optional]
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## Dataset Card Contact
{{ dataset_card_contact | default("[More Information Needed]", true)}}
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qianqianliu/vichel_data | 2023-10-19T03:18:21.000Z | [
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chirunder/MixAtis_inference | 2023-10-19T07:33:13.000Z | [
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# Dataset Card for "MixAtis_inference"
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adityarra07/train_1000 | 2023-10-19T11:40:44.000Z | [
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tyzhu/find_last_sent_train_30_eval_10 | 2023-10-31T14:47:32.000Z | [
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# Dataset Card for "find_last_sent_train_30_eval_10"
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tyzhu/find_first_sent_train_50_eval_10 | 2023-10-31T14:47:54.000Z | [
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# Dataset Card for "find_first_sent_train_50_eval_10"
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tyzhu/find_second_sent_train_100_eval_10 | 2023-10-31T14:48:39.000Z | [
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# Dataset Card for "find_second_sent_train_100_eval_10"
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martinsinnona/plotqa | 2023-10-21T19:47:15.000Z | [
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# Dataset Card for "dataset_plotqa"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 391 | [
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Isaak-Carter/JOSIE_v928.13.63_llama | 2023-10-19T17:00:02.000Z | [
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# Dataset Card for "JOSIE_v928.13.63_llama"
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tyzhu/find_last_sent_train_30_eval_10_hint3 | 2023-10-31T14:53:13.000Z | [
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# Dataset Card for "find_last_sent_train_30_eval_10_hint3"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 679 | [
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tyzhu/find_second_sent_train_10_eval_10_hint10 | 2023-10-31T14:50:42.000Z | [
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# Dataset Card for "find_second_sent_train_10_eval_10_hint10"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 680 | [
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Skiqq/cookie-data | 2023-10-19T23:23:59.000Z | [
"region:us"
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myrulezzzz/security | 2023-10-20T07:41:44.000Z | [
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nickaskew001/ep_sensetalk | 2023-10-24T07:44:38.000Z | [
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cmu-mlsp/encodec_24khz-librispeech_asr-train.clean.100-features | 2023-10-20T09:16:41.000Z | [
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# Dataset Card for "encodec_24khz-librispeech_asr-train.clean.100-features"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 796 | [
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ebony59/20231012_chai_prize_reward_model_tiny_random_data | 2023-10-20T09:52:42.000Z | [
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# Dataset Card for "20231012_chai_prize_reward_model_tiny_random_data"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 423 | [
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haseong8012/child-50k-adult-30k_for-train | 2023-10-20T12:36:56.000Z | [
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] | haseong8012 | null | null | 0 | 4 | 2023-10-20T11:09:55 | ---
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# Dataset Card for "child-50k-adult-30k_for-train"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 508 | [
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cmu-mlsp/encodec_24khz-librispeech_asr-test.clean-features | 2023-10-20T16:29:59.000Z | [
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# Dataset Card for "encodec_24khz-librispeech_asr-test.clean-features"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 769 | [
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sam2ai/hindi_hellaswag_mini | 2023-10-20T23:30:25.000Z | [
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# Dataset Card for "hindi_hellaswag_mini"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 527 | [
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vietlegalqa/tvpl_21_10_2023 | 2023-10-21T08:33:33.000Z | [
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---
# Dataset Card for "tvpl_21_10_2023"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 680 | [
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AneeqMalik/test_audio_clips | 2023-10-25T19:02:10.000Z | [
"region:us"
] | AneeqMalik | null | null | 0 | 4 | 2023-10-21T09:24:04 | ---
dataset_info:
features:
- name: audio
dtype: audio
- name: audio_names
dtype: string
- name: class_label
dtype:
class_label:
names:
'0': bad
'1': okay
'2': good
'3': great
splits:
- name: train
num_bytes: 12388426.0
num_examples: 6
download_size: 12391305
dataset_size: 12388426.0
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
---
Follow these steps to set up and upload your audio dataset to Hugging Face:
* **Create a Virtual Environment**
- Start by creating a virtual environment on your machine. Run the following commands:
# On Windows
```
python -m venv env
./env/Scripts/activate
```
# On macOS/Linux
```
source env/bin/activate
pip install -r requirements.txt
```
* **Generate a Hugging Face Token**
- To interact with Hugging Face and push datasets, you'll need a Hugging Face access token. Follow these steps to generate one:
- Go to [Hugging Face Settings](https://huggingface.co/settings/tokens).
- Click on "New Token."
- Give the token a name and select the Role as "Write."
- Copy the generated token.
* **Configure Your Token**
- Run the following command, replacing `'YOUR_TOKEN_HERE'` with the token you obtained from Hugging Face:
```bash
python -c "from huggingface_hub.hf_api import HfFolder; HfFolder.save_token('YOUR_TOKEN_HERE')"
```
This command will configure your environment with your Hugging Face token.
* **Modify `main.py`**
- In the `main.py` file, make the following changes:
- Replace `'Enter-Your-hub-name'` with the name of your dataset. For example, use `'AneeqMalik/test_audio_clips'`.
```python
audio_dataset.push_to_hub("Enter-Your-hub-name")
```
This line specifies where your dataset will be pushed on Hugging Face.
* **Run the Code**
- To push your audio dataset to Hugging Face, execute the following command:
```bash
python main.py
```
Your audio dataset will be uploaded to Hugging Face under the specified name.
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aoome123/voice | 2023-10-21T11:09:57.000Z | [
"region:us"
] | aoome123 | null | null | 0 | 4 | 2023-10-21T11:09:57 | Entry not found | 15 | [
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pedropauletti/processed_librispeech_pt | 2023-10-22T01:28:27.000Z | [
"region:us"
] | pedropauletti | null | null | 0 | 4 | 2023-10-21T20:58:21 | ---
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
- split: test
path: data/test-*
dataset_info:
features:
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sequence: int32
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sequence:
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- name: test
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num_examples: 517
download_size: 1435028022
dataset_size: 1609781649.9256773
---
# Dataset Card for "processed_librispeech_pt"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 699 | [
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SebRincon/hacktx-fintechbot | 2023-10-22T02:56:35.000Z | [
"region:us"
] | SebRincon | null | null | 0 | 4 | 2023-10-21T22:09:29 | Entry not found | 15 | [
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aiface/en-vi-opus | 2023-10-22T06:23:09.000Z | [
"region:us"
] | aiface | null | null | 0 | 4 | 2023-10-22T06:23:01 | ---
configs:
- config_name: default
data_files:
- split: test
path: data/test-*
- split: train
path: data/train-*
- split: validation
path: data/validation-*
dataset_info:
features:
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- name: validation
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num_examples: 2000
download_size: 54167292
dataset_size: 294887264
---
# Dataset Card for "en-vi-opus"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 748 | [
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pbaoo2705/covidqa_processed | 2023-10-22T09:01:30.000Z | [
"region:us"
] | pbaoo2705 | null | null | 0 | 4 | 2023-10-22T09:01:28 | ---
dataset_info:
features:
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dataset_size: 6915408
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
---
# Dataset Card for "covidqa_processed"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 616 | [
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wbxlala/eegimage2 | 2023-10-22T11:26:43.000Z | [
"region:us"
] | wbxlala | null | null | 0 | 4 | 2023-10-22T11:25:49 | ---
dataset_info:
features:
- name: image
dtype: image
- name: label
dtype: int64
splits:
- name: train
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num_examples: 7360
- name: test
num_bytes: 98370684.0
num_examples: 2300
download_size: 414779791
dataset_size: 413159313.2
---
# Dataset Card for "eegimage2"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 458 | [
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benayas/snips_llm_v1 | 2023-10-22T16:33:16.000Z | [
"region:us"
] | benayas | null | null | 0 | 4 | 2023-10-22T15:47:07 | ---
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
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path: data/test-*
dataset_info:
features:
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num_bytes: 5215454
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- name: test
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num_examples: 1400
download_size: 769803
dataset_size: 5774924
---
# Dataset Card for "snips_llm_v1"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 575 | [
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AdapterOcean/physics_dataset_standardized_cluster_4_alpaca | 2023-10-23T01:53:05.000Z | [
"region:us"
] | AdapterOcean | null | null | 0 | 4 | 2023-10-22T18:31:40 | ---
dataset_info:
features:
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num_examples: 3437
download_size: 0
dataset_size: 7334043
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
---
# Dataset Card for "physics_dataset_standardized_cluster_4_alpaca"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 503 | [
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AdapterOcean/chemistry_dataset_standardized_cluster_1_alpaca | 2023-10-22T21:15:16.000Z | [
"region:us"
] | AdapterOcean | null | null | 0 | 4 | 2023-10-22T21:15:14 | ---
dataset_info:
features:
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configs:
- config_name: default
data_files:
- split: train
path: data/train-*
---
# Dataset Card for "chemistry_dataset_standardized_cluster_1_alpaca"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 511 | [
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AdapterOcean/chemistry_dataset_standardized_cluster_4_alpaca | 2023-10-22T21:16:23.000Z | [
"region:us"
] | AdapterOcean | null | null | 0 | 4 | 2023-10-22T21:16:21 | ---
dataset_info:
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configs:
- config_name: default
data_files:
- split: train
path: data/train-*
---
# Dataset Card for "chemistry_dataset_standardized_cluster_4_alpaca"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 511 | [
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fmagot01/videos | 2023-10-22T22:50:09.000Z | [
"region:us"
] | fmagot01 | null | null | 0 | 4 | 2023-10-22T22:50:06 | ---
configs:
- config_name: default
data_files:
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path: data/train-*
dataset_info:
features:
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splits:
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num_bytes: 4184462
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dataset_size: 4184462
---
# Dataset Card for "videos"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 520 | [
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AdapterOcean/Open_Platypus_standardized_cluster_0 | 2023-10-23T20:48:50.000Z | [
"region:us"
] | AdapterOcean | null | null | 0 | 4 | 2023-10-22T23:16:01 | ---
dataset_info:
features:
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configs:
- config_name: default
data_files:
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path: data/train-*
---
# Dataset Card for "Open_Platypus_standardized_cluster_0"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 580 | [
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AdapterOcean/Open_Platypus_standardized_cluster_1 | 2023-10-23T20:49:16.000Z | [
"region:us"
] | AdapterOcean | null | null | 0 | 4 | 2023-10-22T23:16:26 | ---
dataset_info:
features:
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configs:
- config_name: default
data_files:
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path: data/train-*
---
# Dataset Card for "Open_Platypus_standardized_cluster_1"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 580 | [
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Minglii/r_pv4_alp | 2023-10-23T00:13:39.000Z | [
"region:us"
] | Minglii | null | null | 0 | 4 | 2023-10-23T00:11:50 | ---
dataset_info:
features:
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configs:
- config_name: default
data_files:
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path: data/train-*
---
# Dataset Card for "r_pv4_alp"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 591 | [
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Minglii/r_pv4_wiz70 | 2023-10-23T00:14:23.000Z | [
"region:us"
] | Minglii | null | null | 0 | 4 | 2023-10-23T00:12:04 | ---
dataset_info:
features:
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configs:
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data_files:
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path: data/train-*
---
# Dataset Card for "r_pv4_wiz70"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 595 | [
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BubbleJoe/Yelp_for_seq_classification | 2023-10-23T01:17:48.000Z | [
"region:us"
] | BubbleJoe | null | null | 0 | 4 | 2023-10-23T01:17:41 | ---
dataset_info:
features:
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download_size: 87302851
dataset_size: 142067655
---
# Dataset Card for "Yelp_for_seq_classification"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 618 | [
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quyanh/cot | 2023-10-25T09:02:23.000Z | [
"region:us"
] | quyanh | null | null | 0 | 4 | 2023-10-23T08:04:26 | ---
dataset_info:
features:
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dataset_size: 3530400.0
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
---
# Dataset Card for "cot"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 474 | [
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datajuicer/the-pile-philpaper-refined-by-data-juicer | 2023-10-23T08:33:30.000Z | [
"task_categories:text-generation",
"size_categories:10K<n<100K",
"language:en",
"license:apache-2.0",
"data-juicer",
"pretraining",
"region:us"
] | datajuicer | null | null | 0 | 4 | 2023-10-23T08:16:41 | ---
license: apache-2.0
tags:
- data-juicer
- pretraining
task_categories:
- text-generation
language:
- en
size_categories:
- 10K<n<100K
---
# The Pile -- PhilPaper (refined by Data-Juicer)
A refined version of PhilPaper dataset in The Pile by [Data-Juicer](https://github.com/alibaba/data-juicer). Removing some "bad" samples from the original dataset to make it higher-quality.
This dataset is usually used to pretrain a Large Language Model.
**Notice**: Here is a small subset for previewing. The whole dataset is available [here](https://dail-wlcb.oss-cn-wulanchabu.aliyuncs.com/LLM_data/our_refined_datasets/pretraining/the-pile-philpaper-refine-result.jsonl) (About 1.7GB).
## Dataset Information
- Number of samples: 29,117 (Keep ~88.82% from the original dataset)
## Refining Recipe
```yaml
# global parameters
project_name: 'our-recipes-Philpaper'
dataset_path: '/path/to/the/original/dataset/' # path to your dataset directory or file
export_path: 'Philpaper-refine-result.jsonl' # path to your dataset result file
np: 50 # number of subprocess to process your dataset
ds_cache_dir: /cache # path to your dataset cache file
open_tracer: true
# process schedule
# a list of several process operators with their arguments
process:
- clean_email_mapper:
- clean_links_mapper:
- fix_unicode_mapper:
- punctuation_normalization_mapper:
- whitespace_normalization_mapper:
- alphanumeric_filter:
tokenization: false
min_ratio: 0.7 # <3sigma (0.72)
- average_line_length_filter:
max_len: 5e5 # >3sigma (406006)
- character_repetition_filter:
rep_len: 10
max_ratio: 0.2 # >3sigma (0.145)
- flagged_words_filter:
lang: en
tokenization: true
max_ratio: 0.0007 # 3sigma
- language_id_score_filter:
min_score: 0.6
- maximum_line_length_filter:
max_len: 1e6 # 3sigma
- perplexity_filter:
lang: en
max_ppl: 5000
- special_characters_filter:
max_ratio: 0.4 # > 3sigma (0.302)
- words_num_filter:
lang: en
tokenization: true
min_num: 1000
max_num: 2e5 # 3sigma
- word_repetition_filter:
lang: en
tokenization: true
rep_len: 10
max_ratio: 0.3 # > 3sigma (0.249)
- document_simhash_deduplicator:
tokenization: space
window_size: 6
lowercase: true
ignore_pattern: '\p{P}'
num_blocks: 6
hamming_distance: 4
``` | 2,419 | [
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nikhil4544/demo | 2023-10-23T08:34:04.000Z | [
"region:us"
] | nikhil4544 | null | null | 0 | 4 | 2023-10-23T08:33:27 | Entry not found | 15 | [
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jjonhwa/SECOND_SUMMARY_RAW | 2023-10-23T08:59:39.000Z | [
"region:us"
] | jjonhwa | null | null | 0 | 4 | 2023-10-23T08:59:24 | ---
dataset_info:
features:
- name: 문장
dtype: string
- name: 요약
dtype: string
splits:
- name: train
num_bytes: 104066240
num_examples: 30979
download_size: 62857147
dataset_size: 104066240
---
# Dataset Card for "SECOND_SUMMARY_RAW"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 395 | [
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getawayfrommeXD/ner_sentences | 2023-10-23T09:28:47.000Z | [
"region:us"
] | getawayfrommeXD | null | null | 0 | 4 | 2023-10-23T09:28:38 | ---
dataset_info:
features:
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sequence: string
- name: labels
sequence: string
splits:
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- name: validation
num_bytes: 748135
num_examples: 3250
- name: test
num_bytes: 679017
num_examples: 3453
download_size: 1244231
dataset_size: 4402876
---
# Dataset Card for "ner_sentences"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 527 | [
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Henok/amharic-qa | 2023-10-25T19:38:25.000Z | [
"task_categories:question-answering",
"size_categories:1K<n<10K",
"language:am",
"license:mit",
"arxiv:2303.03290",
"region:us"
] | Henok | null | null | 1 | 4 | 2023-10-23T10:25:52 | ---
license: mit
language:
- am
task_categories:
- question-answering
size_categories:
- 1K<n<10K
---
# AmQA: Amharic Question Answering Dataset
Amharic question and answer dataset in a prompt and completion format.
## Dataset Details
In Amharic, interrogative sentences can be formulated using information-seeking pronouns like “ምን” (what), “መቼ” (when), “ማን” (who), “የት” (where), “የትኛው” (which), etc. and prepositional interrogative phrases like “ለምን” [ለ-ምን] (why), “በምን” [በ-ምን] (by what), etc. Besides, a verb phrase could be used to pose questions (Getahun 2013; Baye 2009). As shown bellow, the AmQA dataset contains context, question, and answer triplets. The contexts are articles collected from Amharic Wikipedia dump file. The question-answer pairs are created by crowdsourcing and annotated using the Haystack QA annotation tool. 2628 question and answer pairs are created from 378 documents. The whole AmQA dataset can be found here. We also split the datset into train, dev, and test with a size of 1728, 600, and 300 respectively.
- **Curated by:** [Tilahun Abedissa, Ricardo Usbeck, Yaregal Assabie]
- **Language(s) (NLP):** [Amharic]
- **License:** [MIT]
### Dataset Sources
<!-- Provide the basic links for the dataset. -->
- **Repository:** [https://github.com/semantic-systems/amharic-qa]
- **Paper [optional]:** [https://arxiv.org/abs/2303.03290]
## Dataset Structure
The dataset is restructured in a new JSON format of the following:
```
formatted_json = {
"inputs": "ከዚህ በታች በተገለጸው አውድ ተከታዩን ጥያቄ ይመልሱ፡ {context} {question}",
"targets": "ከጥያቄው ጋር የሚስማማው ምላሽ {answer_text} ነው።",
"inputs": "ከዚህ በታች ያለውን ዝርዝር መረጃ በመጠቀም ለሚከተለው ጥያቄ መልስ ይስጡ፡ {context} {question}",
"targets": "ከጥያቄው አንጻር ትክክለኛው መልስ {answer_text} ነው።",
"inputs": "ከዚህ በታች ያለውን ጽሑፍ በማጣቀስ እባክዎን ለሚከተለው መልስ ይስጡ {context} {question}",
"targets": "ለጥያቄው መልስ {answer_text} ነው።",
"inputs": "የተሰጠውን ጥያቄ ለመመለስ ከዚህ በታች የቀረበውን መረጃ ይመልከቱ፡ {context} {question}",
"targets": "ለተጠቀሰው ጥያቄ ትክክለኛው ምላሽ {answer_text} ነው።",
"inputs": "ለሚከተለው ጥያቄ ምላሽ ለመስጠት ከዚህ በታች የቀረበውን አውድ ተጠቀም፡ {context} {question}",
"targets": "ለጥያቄው መልሱ {answer_text} ነው።",
"inputs": "የተሰጠውን ጥያቄ ከዚህ በታች በተሰጠው አውድ መሰረት መልሱ፡ {context} {question}",
"targets": "ለጥያቄው ትክክለኛው ምላሽ {answer_text} ነው።"
}
```
## Citation
**BibTeX:**
```
[@misc{abedissa2023amqa,
title={AmQA: Amharic Question Answering Dataset},
author={Tilahun Abedissa and Ricardo Usbeck and Yaregal Assabie},
year={2023},
eprint={2303.03290},
archivePrefix={arXiv},
primaryClass={cs.CL}
}]
``` | 2,757 | [
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Luciya/llama-2-clinc-train | 2023-10-23T11:12:30.000Z | [
"region:us"
] | Luciya | null | null | 0 | 4 | 2023-10-23T11:12:26 | ---
dataset_info:
features:
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download_size: 986893
dataset_size: 10464310
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
---
# Dataset Card for "llama-2-clinc-train"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 448 | [
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sayan1101/reward_test_custom_dataset_RLHF | 2023-10-23T11:55:58.000Z | [
"region:us"
] | sayan1101 | null | null | 0 | 4 | 2023-10-23T11:45:02 | ---
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
- split: test
path: data/test-*
- split: valid1
path: data/valid1-*
- split: valid2
path: data/valid2-*
dataset_info:
features:
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splits:
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- name: valid1
num_bytes: 27648
num_examples: 41
- name: valid2
num_bytes: 27648
num_examples: 41
download_size: 101852
dataset_size: 110592
---
# Dataset Card for "reward_test_custom_dataset_RLHF"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 824 | [
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BillieCode/dbt | 2023-10-23T13:46:35.000Z | [
"region:us"
] | BillieCode | null | null | 0 | 4 | 2023-10-23T13:46:14 | Entry not found | 15 | [
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pphuc25/tokenizer-dataset-test | 2023-10-23T17:09:24.000Z | [
"region:us"
] | pphuc25 | null | null | 0 | 4 | 2023-10-23T17:09:22 | ---
dataset_info:
features:
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dtype: int64
splits:
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num_examples: 5717
download_size: 16617181
dataset_size: 31838575
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
---
# Dataset Card for "tokenizer-dataset-test"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 527 | [
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ElvisGitau/Kiswahili-ASR | 2023-10-23T19:55:33.000Z | [
"region:us"
] | ElvisGitau | null | null | 0 | 4 | 2023-10-23T19:42:04 | Entry not found | 15 | [
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Back-up/so_tay_sv_train | 2023-10-24T05:27:16.000Z | [
"region:us"
] | Back-up | null | null | 0 | 4 | 2023-10-24T05:27:14 | ---
dataset_info:
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configs:
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data_files:
- split: train
path: data/train-*
---
# Dataset Card for "so_tay_sv_train"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 503 | [
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Back-up/fix-subdomain-train | 2023-10-24T05:35:24.000Z | [
"region:us"
] | Back-up | null | null | 0 | 4 | 2023-10-24T05:35:22 | ---
dataset_info:
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dataset_size: 771141.6
configs:
- config_name: default
data_files:
- split: test
path: data/test-*
---
# Dataset Card for "fix-subdomain-train"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 486 | [
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Back-up/fix-subdomain-test | 2023-10-24T05:35:25.000Z | [
"region:us"
] | Back-up | null | null | 0 | 4 | 2023-10-24T05:35:24 | ---
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configs:
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data_files:
- split: test
path: data/test-*
---
# Dataset Card for "fix-subdomain-test"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 484 | [
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Luciya/llama-2-clinc-oos-train | 2023-10-24T12:52:48.000Z | [
"region:us"
] | Luciya | null | null | 0 | 4 | 2023-10-24T12:52:47 | ---
dataset_info:
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configs:
- config_name: default
data_files:
- split: train
path: data/train-*
---
# Dataset Card for "llama-2-clinc-oos-train"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 451 | [
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kjappelbaum/chemnlp-chem-caption | 2023-10-29T20:53:39.000Z | [
"region:us"
] | kjappelbaum | null | null | 0 | 4 | 2023-10-24T20:58:29 | ---
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- name: num_nitrogen_atoms
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- name: num_hydrogen_bond_acceptors
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- name: num_lipinski_violations
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- name: pmi2_value
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- name: pmi3_value
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- name: num_chiral_centers
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- name: representation
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- name: __index_level_0__
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splits:
- name: train
num_bytes: 41619636
num_examples: 82337
download_size: 16321406
dataset_size: 41619636
- config_name: rdkit_feat_0
features:
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dtype: int64
- name: representation_type
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- name: 3,5-dimethoxyphenylisoproxycarbonyl_count
dtype: int64
- name: 2-(4-biphenyl)isopropoxycarbonyl_count
dtype: int64
- name: 2-nitrophenylsulfenyl_count
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- name: boc_count
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- name: trt_count
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- name: ddz_count
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- name: bpoc_count
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- name: nps_count
dtype: int64
- name: 9-fluorenylmethoxycarbonyl_count
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- name: 2-(4-nitrophenylsulfonyl)ethoxycarbonyl_count
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- name: (1,1-dioxobenzo[b]thiophene-2-yl)methyloxycarbonyl_count
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- name: (1,1-dioxonaptho[1,2-b]thiophene-2-yl)methyloxycarbonyl_count
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- name: 1-(4,4-dimethyl-2,6-dioxocyclohex-1-ylidene)-3-methylbutyl_count
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- name: 2-fluoro-fmoc_count
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- name: 2-monoisooctyl-fmoc_count
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- name: 2,7-diisooctyl-fmoc_count
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- name: tetrachlorophthaloyl_count
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- name: ethanesulfonylethoxycarbonyl_count
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- name: 2-(4-sulfophenylsulfonyl)ethoxycarbonyl_count
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- name: fmoc_count
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- name: nsc_count
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- name: bsmoc_count
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- name: alpha-nsmoc_count
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- name: ivdde_count
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- name: fmoc*_count
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- name: fmoc(fmoc(2f))_count
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- name: mio-fmoc_count
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- name: dio-fmoc_count
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- name: tcp_count
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- name: esc_count
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- name: sps_count
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- name: benzyloxycarbonyl_count
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- name: allyloxycarbonyl_count
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- name: 2,4-dinitrobenzenesulfonyl_count
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- name: benzothiazole-2-sulfonyl_count
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- name: 2,2,2-trichloroethyloxycarbonyl_count
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- name: dithiasuccinoyl_count
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- name: p-nitrobenzyloxycarbonyl_count
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- name: alpha-azidoacids_count
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- name: proparglyoxycarbonyl_count
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- name: o-nitrobenzylcarbonyl_count
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- name: 4-nitroveratryloxycarbonyl_count
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- name: 2-(2-nitrophenyl)propyloxycarbonyl_count
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- name: 2-(3,4-methylenedioxy-6-nitrophenyl)propyloxycarbonyl_count
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- name: 9-(4-bromophenyl)-9-fluorenyl_count
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- name: azidomethoxycarbonyl_count
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- name: hexafluoroacetone_count
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- name: Z_count
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- name: alloc_count
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- name: o-nbs_count
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- name: d-nbs_count
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- name: bts_count
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- name: troc_count
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- name: dts_count
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- name: pnz_count
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- name: poc_count
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- name: onz_count
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- name: nvoc_count
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- name: nppoc_count
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- name: mnppoc_count
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- name: brphf_count
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- name: azoc_count
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- name: hfa_count
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- name: 2-chlorobenzyloxycarbonyl_count
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- name: 4-methyltrityl_count
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- name: cl-z_count
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- name: 1-(4,4-dimethyl-2,6-dioxocylohex-1-ylidene)-3-methylbutyl_count
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- name: trifluoroacetyl_count
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- name: 2-(methylsulfonyl)ethoxycarbonyl_count
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- name: tfa_count
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- name: msc_count
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- name: phenyldisulphanylethyloxycarbonyl_count
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- name: 2-pyridyldisulphanylethyloxycarbonyl_count
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- name: phdec_count
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- name: pydec_count
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- name: tert-butyl_count
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- name: 2-chlorotrityl_count
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- name: 2-4-dimethyoxybenzyl_count
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- name: 2-phenylisopropyl_count
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- name: 5-phenyl-3,4-ethylenedioxythenyl_count
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- name: bu_count
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- name: 2-cl-trt_count
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- name: dmb_count
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- name: 2-ph-pr_count
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- name: phenyl-edotn_count
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- name: 9-fluorenylmethyl_count
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- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocylocheylidene)-3-methylbutyl]-amino)benzyl_count
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- name: methyl_count
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- name: ethyl_count
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- name: carbamoylmethyl_count
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- name: me_count
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- name: et_count
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- name: cam_count
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- name: allyl_count
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- name: benzyl_count
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- name: p-nitrobenzyl_count
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- name: 2-trimethylsilyethyl_count
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- name: pac_count
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- name: tmse_count
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- name: ptmse_count
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- name: tmsi_count
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- name: tce_count
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- name: php_count
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- name: dmnb_count
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- name: dma_count
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- name: cyclohexyl_count
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- name: b-menthyl_count
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- name: b-3-methylpent-3-yl_count
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- name: 4-(3,6,9-trioxadecyl)oxybenzyl_count
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- name: chx_count
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- name: men_count
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- name: tegbz_count
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- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-methyl-butyl]-amino)benzyl_count
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- name: trimethylsilylethyl_count
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- name: 4,5-dimethoxy-2-nitrobenzyloxycarbonyl_count
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- name: 2,4-dimethoxybenzyl_count
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- name: 2,4,6-trimethoxybenzyl_count
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- name: tmob_count
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- name: mim_count
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- name: edot_count
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- name: 4-methoxy-2-nitro-benzyl_count
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- name: (6-hydroxy-3-oxido-1,3-benz[d]oxathiol-5-yl)methyl_count
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- name: n-boc-n-methyl[2-(methylamino)ethyl]carbamoyl-hmb_count
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- name: 4,4-dimethoxybenzhydryl_count
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- name: 2,2,4,6,7-pentamethyl-2,3-dihydrobenzofuran-5-sulfonyl_count
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- name: 4-methoxy-2,3,6-trimethylphenylsulfonyl_count
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- name: 1,2-dimethylindole-3-sulfonyl_count
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- name: w,w-bis-tert-butyloxycarbonyl_count
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- name: 5-dibenzosuberenyl_count
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- name: 5-dibenzosuberyl_count
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- name: 2-methoxy-5-dibenzosuberyl_count
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- name: tos_count
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- name: pmc_count
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- name: pbf_count
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- name: mts_count
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- name: mtr_count
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- name: mis_count
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- name: bis-boc_count
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- name: suben_count
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- name: sub_count
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- name: mesub_count
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- name: no2_count
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- name: w,w-bis-benzyloxycarbonyl_count
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- name: w,w-bis-allyloxycarbonyl_count
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- name: z-small_count
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- name: p-methylbenzyl_count
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- name: 2,2,4,6,7-pentamethyl-5-dihydrobenzofuranylmethyl_count
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- name: mob_count
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- name: mmt_count
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- name: pmbf_count
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- name: 9-fluororenylmethoxycarbonyl_count
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- name: dnpe_count
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- name: acetamidomethyl_count
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- name: phenylacetamidomethyl_count
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- name: 5-tert-butylmercapto_count
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- name: 3-nitro-2-pyridinesulfenyl_count
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- name: o-nitrobenzyl_count
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- name: 4-picolyl_count
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- name: ninhydrin_count
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- name: acm_count
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- name: phacm_count
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- name: sbu_count
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- name: npys_count
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- name: s-pyr_count
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- name: fsam_count
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- name: onb_count
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- name: nin_count
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- name: n-tosyl_count
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- name: n-trityl_count
dtype: int64
- name: n-monomethoxytrityl_count
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- name: n-methyltrityl_count
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- name: n-tert-butyloxycarbonyl_count
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- name: n-2,4-dimethylpent-3-yloxycarbonyl_count
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- name: n-benzyloxymethyl_count
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- name: n-tert-butoxymethyl_count
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- name: ntos_count
dtype: int64
- name: ntrt_count
dtype: int64
- name: nmtt_count
dtype: int64
- name: nmmt_count
dtype: int64
- name: nboc_count
dtype: int64
- name: ndoc_count
dtype: int64
- name: nbom_count
dtype: int64
- name: nbum_count
dtype: int64
- name: N-9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: N-2,6-dimethoxybenzoyl_count
dtype: int64
- name: dmbz_count
dtype: int64
- name: N-2,4-dinitrophenyl_count
dtype: int64
- name: dnp_count
dtype: int64
- name: cyclohexyl;_count
dtype: int64
- name: tert-butyldimethylsilyl_count
dtype: int64
- name: tbdms_count
dtype: int64
- name: tert-butyldiphenylsilyl_count
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- name: propargyloxycarbonyl_count
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- name: tbdps_count
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- name: 2,6-dichlorobenzyl_count
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- name: 2-bromobenzyl_count
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- name: 2-bromobenzyloxycarbonyl_count
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- name: 3-pentyl_count
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- name: dcb_count
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- name: brbn_count
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- name: brz_count
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- name: pen_count
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- name: tegb_count
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- name: boc-n-methyl-n-[2-(methylamino)ethyl]carbamoyl_count
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- name: boc-nmec_count
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- name: formyl_count
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- name: cyclohexyloxycarbonyl_count
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- name: for_count
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- name: hoc_count
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- name: cyclopropane_count
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- name: spiropentane_count
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- name: cyclobutane_count
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- name: cyclopentane_count
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- name: furan_count
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- name: thiophene_count
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- name: pyrrole_count
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- name: 3H-pyrrole_count
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- name: isothiazole_count
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- name: 1,3,2-dioxazole_count
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- name: 1,3-dioxin_count
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- name: pyridazine_count
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- name: 1,2,4-triazine_count
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- name: 2H-1,3-Oxazine_count
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- name: 1,2,6-Oxathiazine_count
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- name: 1,2,4-Oxadiazine_count
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- name: 1,3,5-Oxadiazine_count
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- name: azepine_count
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- name: oxepin_count
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- name: thiepin_count
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- name: indene_count
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- name: 2H-indene_count
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- name: isobenzofuran_count
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- name: benzo[c]thiophene_count
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- name: 1H-indole_count
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- name: pyrano[3,4-b]-pyrrole_count
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- name: benzisoxazole_count
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- name: benzoxazole_count
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- name: 2,1-benzisoxazole_count
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- name: naphthalene_count
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- name: 1,2,3,4-tetrahydronaphthalene_count
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- name: octahydronaphthalene_count
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- name: 2H-1-benzopyran_count
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- name: 2H-1-benzopyran-2-one_count
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- name: 4H-1-benzopyran-4-one_count
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- name: 1H-2-benzopyran-1-one_count
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- name: 3H-2-benzopyran-1-one_count
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- name: quinoline_count
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- name: isoquinoline_count
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- name: cinnoline_count
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- name: quinazoline_count
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- name: 1,8-napthyhridine_count
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- name: 1,7-napththyridine_count
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- name: 1,5-napththridine_count
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- name: 1,6-napthyridine_count
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- name: 2H-1,3-benzoxazine_count
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- name: 2H-1,4-benzoxazine_count
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- name: 1H-2,3-benzoxazine_count
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- name: 4H-3,1-benzoxazine_count
dtype: int64
- name: 2H-1,2-benzoxazine_count
dtype: int64
- name: 4H-1,3-benzoxazine_count
dtype: int64
- name: anthracene_count
dtype: int64
- name: phenanthrene_count
dtype: int64
- name: phenalene_count
dtype: int64
- name: fluorene_count
dtype: int64
- name: carbazole_count
dtype: int64
- name: xanthene_count
dtype: int64
- name: acridine_count
dtype: int64
- name: norpinane_count
dtype: int64
- name: 7H-purine_count
dtype: int64
- name: steroid_ring_system_count
dtype: int64
- name: imidazole_count
dtype: int64
- name: thiazol-2-amine_count
dtype: int64
- name: tetrazole_count
dtype: int64
- name: cytosine_count
dtype: int64
- name: adenine_count
dtype: int64
- name: 5-methylindole_count
dtype: int64
- name: isocaffeine_count
dtype: int64
- name: tetrazolethiol_count
dtype: int64
- name: 3-methylisoxazole_count
dtype: int64
- name: 1-methylimidazole_count
dtype: int64
- name: 2-methylimidazole_count
dtype: int64
- name: guanine_count
dtype: int64
- name: tosufloxacin_count
dtype: int64
- name: acetamido_count
dtype: int64
- name: acetoacetyl_count
dtype: int64
- name: acetyl_count
dtype: int64
- name: acryloyl_count
dtype: int64
- name: alanyl_count
dtype: int64
- name: beta-alanyl_count
dtype: int64
- name: allylidene_count
dtype: int64
- name: amidino_count
dtype: int64
- name: amino_count
dtype: int64
- name: amyl_count
dtype: int64
- name: anilino_count
dtype: int64
- name: anisidino_count
dtype: int64
- name: anthranoyl_count
dtype: int64
- name: arsino_count
dtype: int64
- name: azelaoyl_count
dtype: int64
- name: azido_count
dtype: int64
- name: azo_count
dtype: int64
- name: azoxy_count
dtype: int64
- name: benzal_count
dtype: int64
- name: benzamido_count
dtype: int64
- name: benzhydrol_count
dtype: int64
- name: benzoxy_count
dtype: int64
- name: benzoyl_count
dtype: int64
- name: benzylidene_count
dtype: int64
- name: benzylidyne_count
dtype: int64
- name: biphenylyl_count
dtype: int64
- name: biphenylene_count
dtype: int64
- name: butoxy_count
dtype: int64
- name: sec-butoxy_count
dtype: int64
- name: tert-butoxy_count
dtype: int64
- name: butyl_count
dtype: int64
- name: sec-butyl_count
dtype: int64
- name: butyryl_count
dtype: int64
- name: caproyl_count
dtype: int64
- name: capryl_count
dtype: int64
- name: capryloyl_count
dtype: int64
- name: carbamido_count
dtype: int64
- name: carbamoyl_count
dtype: int64
- name: carbamyl_count
dtype: int64
- name: carbazoyl_count
dtype: int64
- name: carbethoxy_count
dtype: int64
- name: carbonyl_count
dtype: int64
- name: carboxy_count
dtype: int64
- name: cetyl_count
dtype: int64
- name: chloroformyl_count
dtype: int64
- name: cinnamoyl_count
dtype: int64
- name: cinnamyl_count
dtype: int64
- name: cinnamylidene_count
dtype: int64
- name: cresyl_count
dtype: int64
- name: crotonoyl_count
dtype: int64
- name: crotyl_count
dtype: int64
- name: cyanamido_count
dtype: int64
- name: cyanato_count
dtype: int64
- name: cyano_count
dtype: int64
- name: decanedioyl_count
dtype: int64
- name: decanoyl_count
dtype: int64
- name: diazo_count
dtype: int64
- name: diazoamino_count
dtype: int64
- name: disilanyl_count
dtype: int64
- name: disiloxanyloxy_count
dtype: int64
- name: disulfinyl_count
dtype: int64
- name: dithio_count
dtype: int64
- name: enanthoyl_count
dtype: int64
- name: epoxy_count
dtype: int64
- name: ethenyl_count
dtype: int64
- name: ethynyl_count
dtype: int64
- name: ethoxy_count
dtype: int64
- name: ethylene_count
dtype: int64
- name: ethylidene_count
dtype: int64
- name: ethylthio_count
dtype: int64
- name: formamido_count
dtype: int64
- name: furmaroyl_count
dtype: int64
- name: furfuryl_count
dtype: int64
- name: furfurylidene_count
dtype: int64
- name: glutamoyl_count
dtype: int64
- name: glutaryl_count
dtype: int64
- name: glycylamino_count
dtype: int64
- name: glycoloyl_count
dtype: int64
- name: glycyl_count
dtype: int64
- name: glyoxyoyl_count
dtype: int64
- name: guanidino_count
dtype: int64
- name: guanyl_count
dtype: int64
- name: heptadecanoyl_count
dtype: int64
- name: heptanamido_count
dtype: int64
- name: heptanoyl_count
dtype: int64
- name: hexadecanoyl_count
dtype: int64
- name: hexamethylene_count
dtype: int64
- name: hexanedioyl_count
dtype: int64
- name: hippuryl_count
dtype: int64
- name: hydrazino_count
dtype: int64
- name: hydrazo_count
dtype: int64
- name: hydrocinnamoyl_count
dtype: int64
- name: hydroperoxy_count
dtype: int64
- name: hydroxyamino_count
dtype: int64
- name: imino_count
dtype: int64
- name: iodoso_count
dtype: int64
- name: iodyl_count
dtype: int64
- name: isoamyl_count
dtype: int64
- name: isobutenyl_count
dtype: int64
- name: isobutoxy_count
dtype: int64
- name: isobutyl_count
dtype: int64
- name: isobutylidene_count
dtype: int64
- name: isobutyryl_count
dtype: int64
- name: isocyanato_count
dtype: int64
- name: isocyano_count
dtype: int64
- name: isohexyl_count
dtype: int64
- name: isoleucyl_count
dtype: int64
- name: isonitroso_count
dtype: int64
- name: isopentyl_count
dtype: int64
- name: isopentylidene_count
dtype: int64
- name: isopropenyl_count
dtype: int64
- name: isopropoxy_count
dtype: int64
- name: isopropyl_count
dtype: int64
- name: isopropylidene_count
dtype: int64
- name: isothiocynato_count
dtype: int64
- name: isovaleryl_count
dtype: int64
- name: lactoyl_count
dtype: int64
- name: lauroyl_count
dtype: int64
- name: lauryl_count
dtype: int64
- name: leucyl_count
dtype: int64
- name: levulinoyl_count
dtype: int64
- name: malonyl_count
dtype: int64
- name: mandeloyl_count
dtype: int64
- name: mercapto_count
dtype: int64
- name: mesityl_count
dtype: int64
- name: methacryloyl_count
dtype: int64
- name: methallyl_count
dtype: int64
- name: methionyl_count
dtype: int64
- name: methoxy_count
dtype: int64
- name: methylene_count
dtype: int64
- name: methylthio_count
dtype: int64
- name: myristoyl_count
dtype: int64
- name: myristyl_count
dtype: int64
- name: naphthyl_count
dtype: int64
- name: naphthylene_count
dtype: int64
- name: neopentyl_count
dtype: int64
- name: nitramino_count
dtype: int64
- name: nitrosamino_count
dtype: int64
- name: nitroso_count
dtype: int64
- name: nonanoyl_count
dtype: int64
- name: oleoyl_count
dtype: int64
- name: oxalyl_count
dtype: int64
- name: oxo_count
dtype: int64
- name: palmitoyl_count
dtype: int64
- name: pentamethylene_count
dtype: int64
- name: pentyl_count
dtype: int64
- name: tert-pentyl_count
dtype: int64
- name: phenacylidene_count
dtype: int64
- name: phenethyl_count
dtype: int64
- name: phenoxy_count
dtype: int64
- name: phenyl_count
dtype: int64
- name: phenylene_count
dtype: int64
- name: phosphino_count
dtype: int64
- name: phosphinyl_count
dtype: int64
- name: phospho_count
dtype: int64
- name: phosphono_count
dtype: int64
- name: phthaloyl_count
dtype: int64
- name: picryl_count
dtype: int64
- name: pimeloyl_count
dtype: int64
- name: piperidino_count
dtype: int64
- name: pivaloyl_count
dtype: int64
- name: prenyl_count
dtype: int64
- name: propargyl_count
dtype: int64
- name: 1-propenyl_count
dtype: int64
- name: 2-propenyl_count
dtype: int64
- name: propionyl_count
dtype: int64
- name: propoxy_count
dtype: int64
- name: propyl_count
dtype: int64
- name: propylidene_count
dtype: int64
- name: pyrryl_count
dtype: int64
- name: salicyloyl_count
dtype: int64
- name: selenyl_count
dtype: int64
- name: seryl_count
dtype: int64
- name: siloxy_count
dtype: int64
- name: silyl_count
dtype: int64
- name: silyene_count
dtype: int64
- name: sorboyl_count
dtype: int64
- name: stearoyl_count
dtype: int64
- name: stearyl_count
dtype: int64
- name: styryl_count
dtype: int64
- name: suberoyl_count
dtype: int64
- name: succinyl_count
dtype: int64
- name: sulfamino_count
dtype: int64
- name: sulfamoyl_count
dtype: int64
- name: sulfanilyl_count
dtype: int64
- name: sulfeno_count
dtype: int64
- name: sulfhydryl_count
dtype: int64
- name: sulfinyl_count
dtype: int64
- name: sulfo_count
dtype: int64
- name: sulfonyl_count
dtype: int64
- name: terephthaloyl_count
dtype: int64
- name: tetramethylene_count
dtype: int64
- name: thienyl_count
dtype: int64
- name: thiocarbonyl_count
dtype: int64
- name: thiocarboxy_count
dtype: int64
- name: thiocyanato_count
dtype: int64
- name: thionyl_count
dtype: int64
- name: threonyl_count
dtype: int64
- name: toluidino_count
dtype: int64
- name: toluoyl_count
dtype: int64
- name: tolyl_count
dtype: int64
- name: alpha-tolyl_count
dtype: int64
- name: tolylene_count
dtype: int64
- name: tosyl_count
dtype: int64
- name: triazano_count
dtype: int64
- name: trimethylene_count
dtype: int64
- name: valeryl_count
dtype: int64
- name: valyl_count
dtype: int64
- name: vinyl_count
dtype: int64
- name: vinylidene_count
dtype: int64
- name: xylidino_count
dtype: int64
- name: xylyl_count
dtype: int64
- name: xylylene_count
dtype: int64
- name: propiolamide_count
dtype: int64
- name: fumarate ester_count
dtype: int64
- name: allenamide_count
dtype: int64
- name: propiolonitrile_count
dtype: int64
- name: propargylamide_count
dtype: int64
- name: arylsulfonyl bicyclobutane_count
dtype: int64
- name: haloalkane_count
dtype: int64
- name: alpha-halomethyl_count
dtype: int64
- name: alpha-haloamide_count
dtype: int64
- name: alpha-haloester_count
dtype: int64
- name: epoxide_count
dtype: int64
- name: aziridine_count
dtype: int64
- name: nitroalkane_count
dtype: int64
- name: acrylamide_count
dtype: int64
- name: cyanoenone_count
dtype: int64
- name: aldehyde_count
dtype: int64
- name: ketone_count
dtype: int64
- name: nitrile_count
dtype: int64
- name: cyanamide_count
dtype: int64
- name: isothicyanate_count
dtype: int64
- name: sulfone_count
dtype: int64
- name: sulfonyl fluoride_count
dtype: int64
- name: sulfonimidoyl fluoride_count
dtype: int64
- name: aryl fluorosulfate_count
dtype: int64
- name: ester_count
dtype: int64
- name: sulfonamide_count
dtype: int64
- name: 2-carbonyl arylboronic acid_count
dtype: int64
- name: n-methyl isoxazolium_count
dtype: int64
- name: oxaziridine_count
dtype: int64
- name: carboxyl_count
dtype: int64
- name: ether_count
dtype: int64
- name: alkanol_count
dtype: int64
- name: thiol_count
dtype: int64
- name: halogen_count
dtype: int64
- name: amine_count
dtype: int64
- name: amide_count
dtype: int64
- name: num_valence_electrons
dtype: int64
- name: rotable_proportion
dtype: float64
- name: non_rotable_proportion
dtype: float64
- name: num_unspecified_bond
dtype: float64
- name: num_single_bonds
dtype: float64
- name: num_double_bonds
dtype: float64
- name: num_triple_bonds
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- name: num_quadruple_bonds
dtype: float64
- name: num_quintuple_bonds
dtype: float64
- name: num_hextuple_bonds
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- name: num_oneandahalf_bonds
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- name: num_twoandahalf_bonds
dtype: float64
- name: num_threeandahalf_bonds
dtype: float64
- name: num_fourandahalf_bonds
dtype: float64
- name: num_fiveandahalf_bonds
dtype: float64
- name: num_aromatic_bonds
dtype: float64
- name: num_ionic_bonds
dtype: float64
- name: num_hydrogen_bonds
dtype: float64
- name: num_threecenter_bonds
dtype: float64
- name: num_dativeone_bonds
dtype: float64
- name: num_dative_bonds
dtype: float64
- name: num_other_bonds
dtype: float64
- name: num_zero_bonds
dtype: float64
- name: num_bonds
dtype: int64
- name: molecular_formula
dtype: string
- name: monoisotopic_molecular_mass
dtype: float64
- name: carbon_mass
dtype: float64
- name: hydrogen_mass
dtype: float64
- name: nitrogen_mass
dtype: float64
- name: oxygen_mass
dtype: float64
- name: num_carbon_atoms
dtype: int64
- name: num_hydrogen_atoms
dtype: int64
- name: num_nitrogen_atoms
dtype: int64
- name: num_oxygen_atoms
dtype: int64
- name: num_hydrogen_bond_acceptors
dtype: int64
- name: num_hydrogen_bond_donors
dtype: int64
- name: num_lipinski_violations
dtype: int64
- name: inertial_shape_factor
dtype: float64
- name: eccentricity
dtype: float64
- name: asphericity
dtype: float64
- name: npr1_value
dtype: float64
- name: npr2_value
dtype: float64
- name: pmi1_value
dtype: float64
- name: pmi2_value
dtype: float64
- name: pmi3_value
dtype: float64
- name: num_chiral_centers
dtype: int64
- name: representation
dtype: string
splits:
- name: train
num_bytes: 2764418
num_examples: 500
download_size: 488332
dataset_size: 2764418
- config_name: rdkit_feat_1
features:
- name: tert-butyloxycarbonyl_count
dtype: int64
- name: representation_type
dtype: string
- name: trityl_count
dtype: int64
- name: 3,5-dimethoxyphenylisoproxycarbonyl_count
dtype: int64
- name: 2-(4-biphenyl)isopropoxycarbonyl_count
dtype: int64
- name: 2-nitrophenylsulfenyl_count
dtype: int64
- name: boc_count
dtype: int64
- name: trt_count
dtype: int64
- name: ddz_count
dtype: int64
- name: bpoc_count
dtype: int64
- name: nps_count
dtype: int64
- name: 9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: 2-(4-nitrophenylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: (1,1-dioxobenzo[b]thiophene-2-yl)methyloxycarbonyl_count
dtype: int64
- name: (1,1-dioxonaptho[1,2-b]thiophene-2-yl)methyloxycarbonyl_count
dtype: int64
- name: 1-(4,4-dimethyl-2,6-dioxocyclohex-1-ylidene)-3-methylbutyl_count
dtype: int64
- name: 2,7-di-tert-butyl-fmoc_count
dtype: int64
- name: 2-fluoro-fmoc_count
dtype: int64
- name: 2-monoisooctyl-fmoc_count
dtype: int64
- name: 2,7-diisooctyl-fmoc_count
dtype: int64
- name: tetrachlorophthaloyl_count
dtype: int64
- name: 2-[phenyl(methyl)sulfonio])ethyloxycarbonyltetrafluoroborate_count
dtype: int64
- name: ethanesulfonylethoxycarbonyl_count
dtype: int64
- name: 2-(4-sulfophenylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: fmoc_count
dtype: int64
- name: nsc_count
dtype: int64
- name: bsmoc_count
dtype: int64
- name: alpha-nsmoc_count
dtype: int64
- name: ivdde_count
dtype: int64
- name: fmoc*_count
dtype: int64
- name: fmoc(fmoc(2f))_count
dtype: int64
- name: mio-fmoc_count
dtype: int64
- name: dio-fmoc_count
dtype: int64
- name: tcp_count
dtype: int64
- name: pms_count
dtype: int64
- name: esc_count
dtype: int64
- name: sps_count
dtype: int64
- name: benzyloxycarbonyl_count
dtype: int64
- name: allyloxycarbonyl_count
dtype: int64
- name: o-nitrobenzenesulfonyl_count
dtype: int64
- name: 2,4-dinitrobenzenesulfonyl_count
dtype: int64
- name: benzothiazole-2-sulfonyl_count
dtype: int64
- name: 2,2,2-trichloroethyloxycarbonyl_count
dtype: int64
- name: dithiasuccinoyl_count
dtype: int64
- name: p-nitrobenzyloxycarbonyl_count
dtype: int64
- name: alpha-azidoacids_count
dtype: int64
- name: proparglyoxycarbonyl_count
dtype: int64
- name: o-nitrobenzylcarbonyl_count
dtype: int64
- name: 4-nitroveratryloxycarbonyl_count
dtype: int64
- name: 2-(2-nitrophenyl)propyloxycarbonyl_count
dtype: int64
- name: 2-(3,4-methylenedioxy-6-nitrophenyl)propyloxycarbonyl_count
dtype: int64
- name: 9-(4-bromophenyl)-9-fluorenyl_count
dtype: int64
- name: azidomethoxycarbonyl_count
dtype: int64
- name: hexafluoroacetone_count
dtype: int64
- name: Z_count
dtype: int64
- name: alloc_count
dtype: int64
- name: o-nbs_count
dtype: int64
- name: d-nbs_count
dtype: int64
- name: bts_count
dtype: int64
- name: troc_count
dtype: int64
- name: dts_count
dtype: int64
- name: pnz_count
dtype: int64
- name: poc_count
dtype: int64
- name: onz_count
dtype: int64
- name: nvoc_count
dtype: int64
- name: nppoc_count
dtype: int64
- name: mnppoc_count
dtype: int64
- name: brphf_count
dtype: int64
- name: azoc_count
dtype: int64
- name: hfa_count
dtype: int64
- name: 2-chlorobenzyloxycarbonyl_count
dtype: int64
- name: 4-methyltrityl_count
dtype: int64
- name: cl-z_count
dtype: int64
- name: mtt_count
dtype: int64
- name: 1-(4,4-dimethyl-2,6-dioxocylohex-1-ylidene)-3-methylbutyl_count
dtype: int64
- name: trifluoroacetyl_count
dtype: int64
- name: 2-(methylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: tfa_count
dtype: int64
- name: msc_count
dtype: int64
- name: phenyldisulphanylethyloxycarbonyl_count
dtype: int64
- name: 2-pyridyldisulphanylethyloxycarbonyl_count
dtype: int64
- name: phdec_count
dtype: int64
- name: pydec_count
dtype: int64
- name: tert-butyl_count
dtype: int64
- name: 2-chlorotrityl_count
dtype: int64
- name: 2-4-dimethyoxybenzyl_count
dtype: int64
- name: 2-phenylisopropyl_count
dtype: int64
- name: 5-phenyl-3,4-ethylenedioxythenyl_count
dtype: int64
- name: bu_count
dtype: int64
- name: 2-cl-trt_count
dtype: int64
- name: dmb_count
dtype: int64
- name: 2-ph-pr_count
dtype: int64
- name: phenyl-edotn_count
dtype: int64
- name: 9-fluorenylmethyl_count
dtype: int64
- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocylocheylidene)-3-methylbutyl]-amino)benzyl_count
dtype: int64
- name: methyl_count
dtype: int64
- name: ethyl_count
dtype: int64
- name: carbamoylmethyl_count
dtype: int64
- name: fm_count
dtype: int64
- name: dmab_count
dtype: int64
- name: me_count
dtype: int64
- name: et_count
dtype: int64
- name: cam_count
dtype: int64
- name: allyl_count
dtype: int64
- name: benzyl_count
dtype: int64
- name: phenacyl_count
dtype: int64
- name: p-nitrobenzyl_count
dtype: int64
- name: 2-trimethylsilyethyl_count
dtype: int64
- name: (2-phenyl-2-trimethylsilyl)ethyl_count
dtype: int64
- name: 2-(trimethylsilyl)isopropyl_count
dtype: int64
- name: 2,2,2-trichloroethyl_count
dtype: int64
- name: p-hydroxyphenacyl_count
dtype: int64
- name: 4,5-dimethyoxy-2-nitrobenzyl_count
dtype: int64
- name: 1,1-dimethylallyl_count
dtype: int64
- name: pentaaminecobalt_III_count
dtype: int64
- name: al_count
dtype: int64
- name: bn_count
dtype: int64
- name: pac_count
dtype: int64
- name: pnb_count
dtype: int64
- name: tmse_count
dtype: int64
- name: ptmse_count
dtype: int64
- name: tmsi_count
dtype: int64
- name: tce_count
dtype: int64
- name: php_count
dtype: int64
- name: dmnb_count
dtype: int64
- name: dma_count
dtype: int64
- name: cyclohexyl_count
dtype: int64
- name: b-menthyl_count
dtype: int64
- name: b-3-methylpent-3-yl_count
dtype: int64
- name: 4-(3,6,9-trioxadecyl)oxybenzyl_count
dtype: int64
- name: chx_count
dtype: int64
- name: men_count
dtype: int64
- name: mpe_count
dtype: int64
- name: tegbz_count
dtype: int64
- name: 9-fluoroenylmethyl_count
dtype: int64
- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-methyl-butyl]-amino)benzyl_count
dtype: int64
- name: trimethylsilylethyl_count
dtype: int64
- name: 4,5-dimethoxy-2-nitrobenzyloxycarbonyl_count
dtype: int64
- name: pseudoprolines_count
dtype: int64
- name: 2-hydroxy-4-methoxybenzyl_count
dtype: int64
- name: 2,4-dimethoxybenzyl_count
dtype: int64
- name: 2,4,6-trimethoxybenzyl_count
dtype: int64
- name: 1-methyl-3-indolylmethyl_count
dtype: int64
- name: 3,4-ethylene-dioxy-2-thenyl_count
dtype: int64
- name: hmb_count
dtype: int64
- name: tmob_count
dtype: int64
- name: mim_count
dtype: int64
- name: edot_count
dtype: int64
- name: 4-methoxy-2-nitro-benzyl_count
dtype: int64
- name: (6-hydroxy-3-oxido-1,3-benz[d]oxathiol-5-yl)methyl_count
dtype: int64
- name: 2-hydroxy-4-methoxy-5-(methylsulfinyl)benzyl_count
dtype: int64
- name: n-boc-n-methyl[2-(methylamino)ethyl]carbamoyl-hmb_count
dtype: int64
- name: 9-xanthenyl_count
dtype: int64
- name: cyclopropyldimethylcarbinyl_count
dtype: int64
- name: 4,4-dimethoxybenzhydryl_count
dtype: int64
- name: xan_count
dtype: int64
- name: cpd_count
dtype: int64
- name: mbh_count
dtype: int64
- name: p-toluenesulfonyl_count
dtype: int64
- name: 2,2,5,7,8-pentamethylchroman-6-sulfonyl_count
dtype: int64
- name: 2,2,4,6,7-pentamethyl-2,3-dihydrobenzofuran-5-sulfonyl_count
dtype: int64
- name: mesityl-2-sulfonyl_count
dtype: int64
- name: 4-methoxy-2,3,6-trimethylphenylsulfonyl_count
dtype: int64
- name: 1,2-dimethylindole-3-sulfonyl_count
dtype: int64
- name: w,w-bis-tert-butyloxycarbonyl_count
dtype: int64
- name: 5-dibenzosuberenyl_count
dtype: int64
- name: 5-dibenzosuberyl_count
dtype: int64
- name: 2-methoxy-5-dibenzosuberyl_count
dtype: int64
- name: nitro_count
dtype: int64
- name: tos_count
dtype: int64
- name: pmc_count
dtype: int64
- name: pbf_count
dtype: int64
- name: mts_count
dtype: int64
- name: mtr_count
dtype: int64
- name: mis_count
dtype: int64
- name: bis-boc_count
dtype: int64
- name: suben_count
dtype: int64
- name: sub_count
dtype: int64
- name: mesub_count
dtype: int64
- name: no2_count
dtype: int64
- name: w,w-bis-benzyloxycarbonyl_count
dtype: int64
- name: w,w-bis-allyloxycarbonyl_count
dtype: int64
- name: z-small_count
dtype: int64
- name: p-methylbenzyl_count
dtype: int64
- name: p-methoxybenzyl_count
dtype: int64
- name: monomethoxytrityl_count
dtype: int64
- name: trimethoxybenzyl_count
dtype: int64
- name: 2,2,4,6,7-pentamethyl-5-dihydrobenzofuranylmethyl_count
dtype: int64
- name: 1-adamantyl_count
dtype: int64
- name: meb_count
dtype: int64
- name: mob_count
dtype: int64
- name: mmt_count
dtype: int64
- name: pmbf_count
dtype: int64
- name: 1-ada_count
dtype: int64
- name: 2-(2,4-dinitrophenyl)ethyl_count
dtype: int64
- name: 9-fluororenylmethoxycarbonyl_count
dtype: int64
- name: dnpe_count
dtype: int64
- name: acetamidomethyl_count
dtype: int64
- name: phenylacetamidomethyl_count
dtype: int64
- name: 5-tert-butylmercapto_count
dtype: int64
- name: 3-nitro-2-pyridinesulfenyl_count
dtype: int64
- name: 2-pyridinesulfenyl_count
dtype: int64
- name: N-allyloxycarbonyl-N-[2,3,5,6-tetrafluoro-4-(phenylthio)phenyl]]aminomethyl_count
dtype: int64
- name: o-nitrobenzyl_count
dtype: int64
- name: 4-picolyl_count
dtype: int64
- name: ninhydrin_count
dtype: int64
- name: acm_count
dtype: int64
- name: phacm_count
dtype: int64
- name: sbu_count
dtype: int64
- name: npys_count
dtype: int64
- name: s-pyr_count
dtype: int64
- name: fsam_count
dtype: int64
- name: onb_count
dtype: int64
- name: nin_count
dtype: int64
- name: n-tosyl_count
dtype: int64
- name: n-trityl_count
dtype: int64
- name: n-monomethoxytrityl_count
dtype: int64
- name: n-methyltrityl_count
dtype: int64
- name: n-tert-butyloxycarbonyl_count
dtype: int64
- name: n-2,4-dimethylpent-3-yloxycarbonyl_count
dtype: int64
- name: n-benzyloxymethyl_count
dtype: int64
- name: n-tert-butoxymethyl_count
dtype: int64
- name: ntos_count
dtype: int64
- name: ntrt_count
dtype: int64
- name: nmtt_count
dtype: int64
- name: nmmt_count
dtype: int64
- name: nboc_count
dtype: int64
- name: ndoc_count
dtype: int64
- name: nbom_count
dtype: int64
- name: nbum_count
dtype: int64
- name: N-9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: N-2,6-dimethoxybenzoyl_count
dtype: int64
- name: dmbz_count
dtype: int64
- name: N-2,4-dinitrophenyl_count
dtype: int64
- name: dnp_count
dtype: int64
- name: cyclohexyl;_count
dtype: int64
- name: tert-butyldimethylsilyl_count
dtype: int64
- name: tbdms_count
dtype: int64
- name: tert-butyldiphenylsilyl_count
dtype: int64
- name: propargyloxycarbonyl_count
dtype: int64
- name: tbdps_count
dtype: int64
- name: 2,6-dichlorobenzyl_count
dtype: int64
- name: 2-bromobenzyl_count
dtype: int64
- name: 2-bromobenzyloxycarbonyl_count
dtype: int64
- name: 3-pentyl_count
dtype: int64
- name: dcb_count
dtype: int64
- name: brbn_count
dtype: int64
- name: brz_count
dtype: int64
- name: pen_count
dtype: int64
- name: tegb_count
dtype: int64
- name: boc-n-methyl-n-[2-(methylamino)ethyl]carbamoyl_count
dtype: int64
- name: boc-nmec_count
dtype: int64
- name: formyl_count
dtype: int64
- name: cyclohexyloxycarbonyl_count
dtype: int64
- name: for_count
dtype: int64
- name: hoc_count
dtype: int64
- name: cyclopropane_count
dtype: int64
- name: spiropentane_count
dtype: int64
- name: cyclobutane_count
dtype: int64
- name: cyclopentane_count
dtype: int64
- name: furan_count
dtype: int64
- name: thiophene_count
dtype: int64
- name: pyrrole_count
dtype: int64
- name: 2H-pyrrole_count
dtype: int64
- name: 3H-pyrrole_count
dtype: int64
- name: pyrazole_count
dtype: int64
- name: 2H-imidazole_count
dtype: int64
- name: 1,2,3-triazole_count
dtype: int64
- name: 1,2,4-triazole_count
dtype: int64
- name: 1,2-dithiole_count
dtype: int64
- name: 1,3-dithiole_count
dtype: int64
- name: 3H-1,2-oxathiole_count
dtype: int64
- name: isoxazole_count
dtype: int64
- name: oxazole_count
dtype: int64
- name: thiazole_count
dtype: int64
- name: isothiazole_count
dtype: int64
- name: 1,2,3-oxadiazole_count
dtype: int64
- name: 1,2,4-oxadiazole_count
dtype: int64
- name: 1,2,5-oxadiazole_count
dtype: int64
- name: 1,3,4-oxadiazole_count
dtype: int64
- name: 1,2,3,4-oxatriazole_count
dtype: int64
- name: 1,2,3,5-oxatriazole_count
dtype: int64
- name: 3H-1,2,3-dioxazole_count
dtype: int64
- name: 1,2,4-dioxazole_count
dtype: int64
- name: 1,3,2-dioxazole_count
dtype: int64
- name: 1,3,4-dioxazole_count
dtype: int64
- name: 5H-1,2,5-oxathiazole_count
dtype: int64
- name: 1,3-oxathiole_count
dtype: int64
- name: benzene_count
dtype: int64
- name: cyclohexane_count
dtype: int64
- name: 2H-pyran_count
dtype: int64
- name: 4H-pyran_count
dtype: int64
- name: 2H-pyran-2-one_count
dtype: int64
- name: 4H-pyran-4-one_count
dtype: int64
- name: 1,2-dioxin_count
dtype: int64
- name: 1,3-dioxin_count
dtype: int64
- name: pyridine_count
dtype: int64
- name: pyridazine_count
dtype: int64
- name: pyrimidine_count
dtype: int64
- name: pyrazine_count
dtype: int64
- name: piperazine_count
dtype: int64
- name: 1,3,5-triazine_count
dtype: int64
- name: 1,2,4-triazine_count
dtype: int64
- name: 1,2,3-triazine_count
dtype: int64
- name: 4H-1,2-Oxazine_count
dtype: int64
- name: 2H-1,3-Oxazine_count
dtype: int64
- name: 6H-1,3-Oxazine_count
dtype: int64
- name: 6H-1,2-Oxazine_count
dtype: int64
- name: 1,4-Oxazine_count
dtype: int64
- name: 2H-1,2-Oxazine_count
dtype: int64
- name: 4H-1,4-Oxazine_count
dtype: int64
- name: 1,2,5-Oxathiazine_count
dtype: int64
- name: 1,2,6-Oxathiazine_count
dtype: int64
- name: 1,2,4-Oxadiazine_count
dtype: int64
- name: 1,3,5-Oxadiazine_count
dtype: int64
- name: morpholine_count
dtype: int64
- name: azepine_count
dtype: int64
- name: oxepin_count
dtype: int64
- name: thiepin_count
dtype: int64
- name: 4H-1,2-diazepine_count
dtype: int64
- name: indene_count
dtype: int64
- name: 2H-indene_count
dtype: int64
- name: benzofuran_count
dtype: int64
- name: isobenzofuran_count
dtype: int64
- name: benzo[b]thiophene_count
dtype: int64
- name: benzo[c]thiophene_count
dtype: int64
- name: indole_count
dtype: int64
- name: 3H-indole_count
dtype: int64
- name: 1H-indole_count
dtype: int64
- name: cyclopenta[b]pyridine_count
dtype: int64
- name: pyrano[3,4-b]-pyrrole_count
dtype: int64
- name: indazole_count
dtype: int64
- name: benzisoxazole_count
dtype: int64
- name: benzoxazole_count
dtype: int64
- name: 2,1-benzisoxazole_count
dtype: int64
- name: naphthalene_count
dtype: int64
- name: 1,2,3,4-tetrahydronaphthalene_count
dtype: int64
- name: octahydronaphthalene_count
dtype: int64
- name: 2H-1-benzopyran_count
dtype: int64
- name: 2H-1-benzopyran-2-one_count
dtype: int64
- name: 4H-1-benzopyran-4-one_count
dtype: int64
- name: 1H-2-benzopyran-1-one_count
dtype: int64
- name: 3H-2-benzopyran-1-one_count
dtype: int64
- name: quinoline_count
dtype: int64
- name: isoquinoline_count
dtype: int64
- name: cinnoline_count
dtype: int64
- name: quinazoline_count
dtype: int64
- name: 1,8-napthyhridine_count
dtype: int64
- name: 1,7-napththyridine_count
dtype: int64
- name: 1,5-napththridine_count
dtype: int64
- name: 1,6-napthyridine_count
dtype: int64
- name: 2H-1,3-benzoxazine_count
dtype: int64
- name: 2H-1,4-benzoxazine_count
dtype: int64
- name: 1H-2,3-benzoxazine_count
dtype: int64
- name: 4H-3,1-benzoxazine_count
dtype: int64
- name: 2H-1,2-benzoxazine_count
dtype: int64
- name: 4H-1,3-benzoxazine_count
dtype: int64
- name: anthracene_count
dtype: int64
- name: phenanthrene_count
dtype: int64
- name: phenalene_count
dtype: int64
- name: fluorene_count
dtype: int64
- name: carbazole_count
dtype: int64
- name: xanthene_count
dtype: int64
- name: acridine_count
dtype: int64
- name: norpinane_count
dtype: int64
- name: 7H-purine_count
dtype: int64
- name: steroid_ring_system_count
dtype: int64
- name: imidazole_count
dtype: int64
- name: thiazol-2-amine_count
dtype: int64
- name: tetrazole_count
dtype: int64
- name: cytosine_count
dtype: int64
- name: adenine_count
dtype: int64
- name: 5-methylindole_count
dtype: int64
- name: isocaffeine_count
dtype: int64
- name: tetrazolethiol_count
dtype: int64
- name: 3-methylisoxazole_count
dtype: int64
- name: 1-methylimidazole_count
dtype: int64
- name: 2-methylimidazole_count
dtype: int64
- name: guanine_count
dtype: int64
- name: tosufloxacin_count
dtype: int64
- name: acetamido_count
dtype: int64
- name: acetoacetyl_count
dtype: int64
- name: acetyl_count
dtype: int64
- name: acryloyl_count
dtype: int64
- name: alanyl_count
dtype: int64
- name: beta-alanyl_count
dtype: int64
- name: allylidene_count
dtype: int64
- name: amidino_count
dtype: int64
- name: amino_count
dtype: int64
- name: amyl_count
dtype: int64
- name: anilino_count
dtype: int64
- name: anisidino_count
dtype: int64
- name: anthranoyl_count
dtype: int64
- name: arsino_count
dtype: int64
- name: azelaoyl_count
dtype: int64
- name: azido_count
dtype: int64
- name: azo_count
dtype: int64
- name: azoxy_count
dtype: int64
- name: benzal_count
dtype: int64
- name: benzamido_count
dtype: int64
- name: benzhydrol_count
dtype: int64
- name: benzoxy_count
dtype: int64
- name: benzoyl_count
dtype: int64
- name: benzylidene_count
dtype: int64
- name: benzylidyne_count
dtype: int64
- name: biphenylyl_count
dtype: int64
- name: biphenylene_count
dtype: int64
- name: butoxy_count
dtype: int64
- name: sec-butoxy_count
dtype: int64
- name: tert-butoxy_count
dtype: int64
- name: butyl_count
dtype: int64
- name: sec-butyl_count
dtype: int64
- name: butyryl_count
dtype: int64
- name: caproyl_count
dtype: int64
- name: capryl_count
dtype: int64
- name: capryloyl_count
dtype: int64
- name: carbamido_count
dtype: int64
- name: carbamoyl_count
dtype: int64
- name: carbamyl_count
dtype: int64
- name: carbazoyl_count
dtype: int64
- name: carbethoxy_count
dtype: int64
- name: carbonyl_count
dtype: int64
- name: carboxy_count
dtype: int64
- name: cetyl_count
dtype: int64
- name: chloroformyl_count
dtype: int64
- name: cinnamoyl_count
dtype: int64
- name: cinnamyl_count
dtype: int64
- name: cinnamylidene_count
dtype: int64
- name: cresyl_count
dtype: int64
- name: crotonoyl_count
dtype: int64
- name: crotyl_count
dtype: int64
- name: cyanamido_count
dtype: int64
- name: cyanato_count
dtype: int64
- name: cyano_count
dtype: int64
- name: decanedioyl_count
dtype: int64
- name: decanoyl_count
dtype: int64
- name: diazo_count
dtype: int64
- name: diazoamino_count
dtype: int64
- name: disilanyl_count
dtype: int64
- name: disiloxanyloxy_count
dtype: int64
- name: disulfinyl_count
dtype: int64
- name: dithio_count
dtype: int64
- name: enanthoyl_count
dtype: int64
- name: epoxy_count
dtype: int64
- name: ethenyl_count
dtype: int64
- name: ethynyl_count
dtype: int64
- name: ethoxy_count
dtype: int64
- name: ethylene_count
dtype: int64
- name: ethylidene_count
dtype: int64
- name: ethylthio_count
dtype: int64
- name: formamido_count
dtype: int64
- name: furmaroyl_count
dtype: int64
- name: furfuryl_count
dtype: int64
- name: furfurylidene_count
dtype: int64
- name: glutamoyl_count
dtype: int64
- name: glutaryl_count
dtype: int64
- name: glycylamino_count
dtype: int64
- name: glycoloyl_count
dtype: int64
- name: glycyl_count
dtype: int64
- name: glyoxyoyl_count
dtype: int64
- name: guanidino_count
dtype: int64
- name: guanyl_count
dtype: int64
- name: heptadecanoyl_count
dtype: int64
- name: heptanamido_count
dtype: int64
- name: heptanoyl_count
dtype: int64
- name: hexadecanoyl_count
dtype: int64
- name: hexamethylene_count
dtype: int64
- name: hexanedioyl_count
dtype: int64
- name: hippuryl_count
dtype: int64
- name: hydrazino_count
dtype: int64
- name: hydrazo_count
dtype: int64
- name: hydrocinnamoyl_count
dtype: int64
- name: hydroperoxy_count
dtype: int64
- name: hydroxyamino_count
dtype: int64
- name: imino_count
dtype: int64
- name: iodoso_count
dtype: int64
- name: iodyl_count
dtype: int64
- name: isoamyl_count
dtype: int64
- name: isobutenyl_count
dtype: int64
- name: isobutoxy_count
dtype: int64
- name: isobutyl_count
dtype: int64
- name: isobutylidene_count
dtype: int64
- name: isobutyryl_count
dtype: int64
- name: isocyanato_count
dtype: int64
- name: isocyano_count
dtype: int64
- name: isohexyl_count
dtype: int64
- name: isoleucyl_count
dtype: int64
- name: isonitroso_count
dtype: int64
- name: isopentyl_count
dtype: int64
- name: isopentylidene_count
dtype: int64
- name: isopropenyl_count
dtype: int64
- name: isopropoxy_count
dtype: int64
- name: isopropyl_count
dtype: int64
- name: isopropylidene_count
dtype: int64
- name: isothiocynato_count
dtype: int64
- name: isovaleryl_count
dtype: int64
- name: lactoyl_count
dtype: int64
- name: lauroyl_count
dtype: int64
- name: lauryl_count
dtype: int64
- name: leucyl_count
dtype: int64
- name: levulinoyl_count
dtype: int64
- name: malonyl_count
dtype: int64
- name: mandeloyl_count
dtype: int64
- name: mercapto_count
dtype: int64
- name: mesityl_count
dtype: int64
- name: methacryloyl_count
dtype: int64
- name: methallyl_count
dtype: int64
- name: methionyl_count
dtype: int64
- name: methoxy_count
dtype: int64
- name: methylene_count
dtype: int64
- name: methylthio_count
dtype: int64
- name: myristoyl_count
dtype: int64
- name: myristyl_count
dtype: int64
- name: naphthyl_count
dtype: int64
- name: naphthylene_count
dtype: int64
- name: neopentyl_count
dtype: int64
- name: nitramino_count
dtype: int64
- name: nitrosamino_count
dtype: int64
- name: nitroso_count
dtype: int64
- name: nonanoyl_count
dtype: int64
- name: oleoyl_count
dtype: int64
- name: oxalyl_count
dtype: int64
- name: oxo_count
dtype: int64
- name: palmitoyl_count
dtype: int64
- name: pentamethylene_count
dtype: int64
- name: pentyl_count
dtype: int64
- name: tert-pentyl_count
dtype: int64
- name: phenacylidene_count
dtype: int64
- name: phenethyl_count
dtype: int64
- name: phenoxy_count
dtype: int64
- name: phenyl_count
dtype: int64
- name: phenylene_count
dtype: int64
- name: phosphino_count
dtype: int64
- name: phosphinyl_count
dtype: int64
- name: phospho_count
dtype: int64
- name: phosphono_count
dtype: int64
- name: phthaloyl_count
dtype: int64
- name: picryl_count
dtype: int64
- name: pimeloyl_count
dtype: int64
- name: piperidino_count
dtype: int64
- name: pivaloyl_count
dtype: int64
- name: prenyl_count
dtype: int64
- name: propargyl_count
dtype: int64
- name: 1-propenyl_count
dtype: int64
- name: 2-propenyl_count
dtype: int64
- name: propionyl_count
dtype: int64
- name: propoxy_count
dtype: int64
- name: propyl_count
dtype: int64
- name: propylidene_count
dtype: int64
- name: pyrryl_count
dtype: int64
- name: salicyloyl_count
dtype: int64
- name: selenyl_count
dtype: int64
- name: seryl_count
dtype: int64
- name: siloxy_count
dtype: int64
- name: silyl_count
dtype: int64
- name: silyene_count
dtype: int64
- name: sorboyl_count
dtype: int64
- name: stearoyl_count
dtype: int64
- name: stearyl_count
dtype: int64
- name: styryl_count
dtype: int64
- name: suberoyl_count
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- name: succinyl_count
dtype: int64
- name: sulfamino_count
dtype: int64
- name: sulfamoyl_count
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- name: sulfanilyl_count
dtype: int64
- name: sulfeno_count
dtype: int64
- name: sulfhydryl_count
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- name: sulfinyl_count
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- name: sulfo_count
dtype: int64
- name: sulfonyl_count
dtype: int64
- name: terephthaloyl_count
dtype: int64
- name: tetramethylene_count
dtype: int64
- name: thienyl_count
dtype: int64
- name: thiocarbonyl_count
dtype: int64
- name: thiocarboxy_count
dtype: int64
- name: thiocyanato_count
dtype: int64
- name: thionyl_count
dtype: int64
- name: threonyl_count
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- name: toluidino_count
dtype: int64
- name: toluoyl_count
dtype: int64
- name: tolyl_count
dtype: int64
- name: alpha-tolyl_count
dtype: int64
- name: tolylene_count
dtype: int64
- name: tosyl_count
dtype: int64
- name: triazano_count
dtype: int64
- name: trimethylene_count
dtype: int64
- name: valeryl_count
dtype: int64
- name: valyl_count
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- name: vinyl_count
dtype: int64
- name: vinylidene_count
dtype: int64
- name: xylidino_count
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- name: xylyl_count
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- name: xylylene_count
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- name: propiolamide_count
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- name: fumarate ester_count
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- name: allenamide_count
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- name: propiolonitrile_count
dtype: int64
- name: propargylamide_count
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- name: arylsulfonyl bicyclobutane_count
dtype: int64
- name: haloalkane_count
dtype: int64
- name: alpha-halomethyl_count
dtype: int64
- name: alpha-haloamide_count
dtype: int64
- name: alpha-haloester_count
dtype: int64
- name: epoxide_count
dtype: int64
- name: aziridine_count
dtype: int64
- name: nitroalkane_count
dtype: int64
- name: acrylamide_count
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- name: cyanoenone_count
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- name: aldehyde_count
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- name: ketone_count
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- name: nitrile_count
dtype: int64
- name: cyanamide_count
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- name: isothicyanate_count
dtype: int64
- name: sulfone_count
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- name: sulfonyl fluoride_count
dtype: int64
- name: sulfonimidoyl fluoride_count
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- name: aryl fluorosulfate_count
dtype: int64
- name: ester_count
dtype: int64
- name: sulfonamide_count
dtype: int64
- name: 2-carbonyl arylboronic acid_count
dtype: int64
- name: n-methyl isoxazolium_count
dtype: int64
- name: oxaziridine_count
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- name: carboxyl_count
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- name: ether_count
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- name: alkanol_count
dtype: int64
- name: thiol_count
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- name: halogen_count
dtype: int64
- name: amine_count
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- name: amide_count
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- name: num_valence_electrons
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- name: rotable_proportion
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- name: non_rotable_proportion
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- name: num_unspecified_bond
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- name: num_single_bonds
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- name: num_quadruple_bonds
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- name: num_quintuple_bonds
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- name: num_hextuple_bonds
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- name: num_oneandahalf_bonds
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- name: num_fourandahalf_bonds
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- name: num_fiveandahalf_bonds
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- name: num_aromatic_bonds
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- name: num_ionic_bonds
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- name: num_hydrogen_bonds
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- name: num_threecenter_bonds
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- name: num_dativeone_bonds
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- name: num_dative_bonds
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- name: num_other_bonds
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- name: num_zero_bonds
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- name: num_bonds
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- name: carbon_mass
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- name: hydrogen_mass
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- name: nitrogen_mass
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- name: oxygen_mass
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- name: num_carbon_atoms
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- name: num_hydrogen_atoms
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- name: num_nitrogen_atoms
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- name: num_oxygen_atoms
dtype: int64
- name: num_hydrogen_bond_acceptors
dtype: int64
- name: num_hydrogen_bond_donors
dtype: int64
- name: num_lipinski_violations
dtype: int64
- name: inertial_shape_factor
dtype: float64
- name: eccentricity
dtype: float64
- name: asphericity
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- name: npr1_value
dtype: float64
- name: npr2_value
dtype: float64
- name: pmi1_value
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- name: pmi2_value
dtype: float64
- name: pmi3_value
dtype: float64
- name: num_chiral_centers
dtype: int64
- name: representation
dtype: string
splits:
- name: train
num_bytes: 2756268
num_examples: 500
download_size: 484582
dataset_size: 2756268
- config_name: rdkit_feat_10
features:
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dtype: int64
- name: representation_type
dtype: string
- name: trityl_count
dtype: int64
- name: 3,5-dimethoxyphenylisoproxycarbonyl_count
dtype: int64
- name: 2-(4-biphenyl)isopropoxycarbonyl_count
dtype: int64
- name: 2-nitrophenylsulfenyl_count
dtype: int64
- name: boc_count
dtype: int64
- name: trt_count
dtype: int64
- name: ddz_count
dtype: int64
- name: bpoc_count
dtype: int64
- name: nps_count
dtype: int64
- name: 9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: 2-(4-nitrophenylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: (1,1-dioxobenzo[b]thiophene-2-yl)methyloxycarbonyl_count
dtype: int64
- name: (1,1-dioxonaptho[1,2-b]thiophene-2-yl)methyloxycarbonyl_count
dtype: int64
- name: 1-(4,4-dimethyl-2,6-dioxocyclohex-1-ylidene)-3-methylbutyl_count
dtype: int64
- name: 2,7-di-tert-butyl-fmoc_count
dtype: int64
- name: 2-fluoro-fmoc_count
dtype: int64
- name: 2-monoisooctyl-fmoc_count
dtype: int64
- name: 2,7-diisooctyl-fmoc_count
dtype: int64
- name: tetrachlorophthaloyl_count
dtype: int64
- name: 2-[phenyl(methyl)sulfonio])ethyloxycarbonyltetrafluoroborate_count
dtype: int64
- name: ethanesulfonylethoxycarbonyl_count
dtype: int64
- name: 2-(4-sulfophenylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: fmoc_count
dtype: int64
- name: nsc_count
dtype: int64
- name: bsmoc_count
dtype: int64
- name: alpha-nsmoc_count
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- name: ivdde_count
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- name: fmoc*_count
dtype: int64
- name: fmoc(fmoc(2f))_count
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- name: mio-fmoc_count
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- name: dio-fmoc_count
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- name: tcp_count
dtype: int64
- name: pms_count
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- name: esc_count
dtype: int64
- name: sps_count
dtype: int64
- name: benzyloxycarbonyl_count
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- name: allyloxycarbonyl_count
dtype: int64
- name: o-nitrobenzenesulfonyl_count
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- name: 2,4-dinitrobenzenesulfonyl_count
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- name: benzothiazole-2-sulfonyl_count
dtype: int64
- name: 2,2,2-trichloroethyloxycarbonyl_count
dtype: int64
- name: dithiasuccinoyl_count
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- name: p-nitrobenzyloxycarbonyl_count
dtype: int64
- name: alpha-azidoacids_count
dtype: int64
- name: proparglyoxycarbonyl_count
dtype: int64
- name: o-nitrobenzylcarbonyl_count
dtype: int64
- name: 4-nitroveratryloxycarbonyl_count
dtype: int64
- name: 2-(2-nitrophenyl)propyloxycarbonyl_count
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- name: 2-(3,4-methylenedioxy-6-nitrophenyl)propyloxycarbonyl_count
dtype: int64
- name: 9-(4-bromophenyl)-9-fluorenyl_count
dtype: int64
- name: azidomethoxycarbonyl_count
dtype: int64
- name: hexafluoroacetone_count
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- name: Z_count
dtype: int64
- name: alloc_count
dtype: int64
- name: o-nbs_count
dtype: int64
- name: d-nbs_count
dtype: int64
- name: bts_count
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- name: troc_count
dtype: int64
- name: dts_count
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- name: pnz_count
dtype: int64
- name: poc_count
dtype: int64
- name: onz_count
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- name: nvoc_count
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- name: nppoc_count
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- name: mnppoc_count
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- name: brphf_count
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- name: azoc_count
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- name: hfa_count
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- name: 2-chlorobenzyloxycarbonyl_count
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- name: 4-methyltrityl_count
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- name: cl-z_count
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- name: mtt_count
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- name: 1-(4,4-dimethyl-2,6-dioxocylohex-1-ylidene)-3-methylbutyl_count
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- name: trifluoroacetyl_count
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- name: 2-(methylsulfonyl)ethoxycarbonyl_count
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- name: tfa_count
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- name: msc_count
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- name: phenyldisulphanylethyloxycarbonyl_count
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- name: 2-pyridyldisulphanylethyloxycarbonyl_count
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- name: phdec_count
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- name: pydec_count
dtype: int64
- name: tert-butyl_count
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- name: 2-chlorotrityl_count
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- name: 2-4-dimethyoxybenzyl_count
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- name: 2-phenylisopropyl_count
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- name: 5-phenyl-3,4-ethylenedioxythenyl_count
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- name: bu_count
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- name: 2-cl-trt_count
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- name: dmb_count
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- name: 2-ph-pr_count
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- name: phenyl-edotn_count
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- name: 9-fluorenylmethyl_count
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- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocylocheylidene)-3-methylbutyl]-amino)benzyl_count
dtype: int64
- name: methyl_count
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- name: ethyl_count
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- name: carbamoylmethyl_count
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- name: fm_count
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- name: dmab_count
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- name: me_count
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- name: et_count
dtype: int64
- name: cam_count
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- name: allyl_count
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- name: benzyl_count
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- name: phenacyl_count
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- name: p-nitrobenzyl_count
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- name: 2-trimethylsilyethyl_count
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- name: (2-phenyl-2-trimethylsilyl)ethyl_count
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- name: 2-(trimethylsilyl)isopropyl_count
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- name: 2,2,2-trichloroethyl_count
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- name: p-hydroxyphenacyl_count
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- name: 4,5-dimethyoxy-2-nitrobenzyl_count
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- name: 1,1-dimethylallyl_count
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- name: pentaaminecobalt_III_count
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- name: al_count
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- name: bn_count
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- name: pac_count
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- name: pnb_count
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- name: tmse_count
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- name: ptmse_count
dtype: int64
- name: tmsi_count
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- name: tce_count
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- name: php_count
dtype: int64
- name: dmnb_count
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- name: dma_count
dtype: int64
- name: cyclohexyl_count
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- name: b-menthyl_count
dtype: int64
- name: b-3-methylpent-3-yl_count
dtype: int64
- name: 4-(3,6,9-trioxadecyl)oxybenzyl_count
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- name: chx_count
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- name: men_count
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- name: mpe_count
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- name: tegbz_count
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- name: 9-fluoroenylmethyl_count
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- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-methyl-butyl]-amino)benzyl_count
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- name: trimethylsilylethyl_count
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- name: 4,5-dimethoxy-2-nitrobenzyloxycarbonyl_count
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- name: pseudoprolines_count
dtype: int64
- name: 2-hydroxy-4-methoxybenzyl_count
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- name: 2,4-dimethoxybenzyl_count
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- name: 2,4,6-trimethoxybenzyl_count
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- name: 1-methyl-3-indolylmethyl_count
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- name: 3,4-ethylene-dioxy-2-thenyl_count
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- name: hmb_count
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- name: tmob_count
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- name: mim_count
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- name: edot_count
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- name: 4-methoxy-2-nitro-benzyl_count
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- name: (6-hydroxy-3-oxido-1,3-benz[d]oxathiol-5-yl)methyl_count
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- name: 2-hydroxy-4-methoxy-5-(methylsulfinyl)benzyl_count
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- name: n-boc-n-methyl[2-(methylamino)ethyl]carbamoyl-hmb_count
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- name: 4,4-dimethoxybenzhydryl_count
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- name: xan_count
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- name: mbh_count
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- name: p-toluenesulfonyl_count
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dtype: int64
- name: 2,2,4,6,7-pentamethyl-2,3-dihydrobenzofuran-5-sulfonyl_count
dtype: int64
- name: mesityl-2-sulfonyl_count
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- name: 4-methoxy-2,3,6-trimethylphenylsulfonyl_count
dtype: int64
- name: 1,2-dimethylindole-3-sulfonyl_count
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- name: w,w-bis-tert-butyloxycarbonyl_count
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- name: 5-dibenzosuberenyl_count
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- name: 5-dibenzosuberyl_count
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- name: 2-methoxy-5-dibenzosuberyl_count
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- name: nitro_count
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- name: tos_count
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- name: pmc_count
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- name: pbf_count
dtype: int64
- name: mts_count
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- name: mtr_count
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- name: mis_count
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- name: bis-boc_count
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- name: suben_count
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- name: sub_count
dtype: int64
- name: mesub_count
dtype: int64
- name: no2_count
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- name: w,w-bis-benzyloxycarbonyl_count
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- name: w,w-bis-allyloxycarbonyl_count
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- name: z-small_count
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- name: p-methylbenzyl_count
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- name: p-methoxybenzyl_count
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- name: monomethoxytrityl_count
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- name: trimethoxybenzyl_count
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- name: 2,2,4,6,7-pentamethyl-5-dihydrobenzofuranylmethyl_count
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- name: 1-adamantyl_count
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- name: meb_count
dtype: int64
- name: mob_count
dtype: int64
- name: mmt_count
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- name: pmbf_count
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- name: 1-ada_count
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- name: 2-(2,4-dinitrophenyl)ethyl_count
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- name: 9-fluororenylmethoxycarbonyl_count
dtype: int64
- name: dnpe_count
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- name: acetamidomethyl_count
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- name: phenylacetamidomethyl_count
dtype: int64
- name: 5-tert-butylmercapto_count
dtype: int64
- name: 3-nitro-2-pyridinesulfenyl_count
dtype: int64
- name: 2-pyridinesulfenyl_count
dtype: int64
- name: N-allyloxycarbonyl-N-[2,3,5,6-tetrafluoro-4-(phenylthio)phenyl]]aminomethyl_count
dtype: int64
- name: o-nitrobenzyl_count
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- name: 4-picolyl_count
dtype: int64
- name: ninhydrin_count
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- name: acm_count
dtype: int64
- name: phacm_count
dtype: int64
- name: sbu_count
dtype: int64
- name: npys_count
dtype: int64
- name: s-pyr_count
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- name: fsam_count
dtype: int64
- name: onb_count
dtype: int64
- name: nin_count
dtype: int64
- name: n-tosyl_count
dtype: int64
- name: n-trityl_count
dtype: int64
- name: n-monomethoxytrityl_count
dtype: int64
- name: n-methyltrityl_count
dtype: int64
- name: n-tert-butyloxycarbonyl_count
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- name: n-2,4-dimethylpent-3-yloxycarbonyl_count
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- name: n-benzyloxymethyl_count
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- name: n-tert-butoxymethyl_count
dtype: int64
- name: ntos_count
dtype: int64
- name: ntrt_count
dtype: int64
- name: nmtt_count
dtype: int64
- name: nmmt_count
dtype: int64
- name: nboc_count
dtype: int64
- name: ndoc_count
dtype: int64
- name: nbom_count
dtype: int64
- name: nbum_count
dtype: int64
- name: N-9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: N-2,6-dimethoxybenzoyl_count
dtype: int64
- name: dmbz_count
dtype: int64
- name: N-2,4-dinitrophenyl_count
dtype: int64
- name: dnp_count
dtype: int64
- name: cyclohexyl;_count
dtype: int64
- name: tert-butyldimethylsilyl_count
dtype: int64
- name: tbdms_count
dtype: int64
- name: tert-butyldiphenylsilyl_count
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- name: propargyloxycarbonyl_count
dtype: int64
- name: tbdps_count
dtype: int64
- name: 2,6-dichlorobenzyl_count
dtype: int64
- name: 2-bromobenzyl_count
dtype: int64
- name: 2-bromobenzyloxycarbonyl_count
dtype: int64
- name: 3-pentyl_count
dtype: int64
- name: dcb_count
dtype: int64
- name: brbn_count
dtype: int64
- name: brz_count
dtype: int64
- name: pen_count
dtype: int64
- name: tegb_count
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- name: boc-n-methyl-n-[2-(methylamino)ethyl]carbamoyl_count
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- name: boc-nmec_count
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- name: formyl_count
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- name: cyclohexyloxycarbonyl_count
dtype: int64
- name: for_count
dtype: int64
- name: hoc_count
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- name: cyclopropane_count
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- name: spiropentane_count
dtype: int64
- name: cyclobutane_count
dtype: int64
- name: cyclopentane_count
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- name: furan_count
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- name: thiophene_count
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- name: pyrrole_count
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- name: 2H-pyrrole_count
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- name: 3H-pyrrole_count
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- name: 1,2,4-triazole_count
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- name: 3H-1,2-oxathiole_count
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- name: isoxazole_count
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- name: oxazole_count
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- name: isothiazole_count
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- name: 1,2,3-oxadiazole_count
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- name: 1,2,4-oxadiazole_count
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- name: 1,2,5-oxadiazole_count
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- name: 1,3,4-oxadiazole_count
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- name: 1,2,3,4-oxatriazole_count
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- name: 1,2,3,5-oxatriazole_count
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- name: 3H-1,2,3-dioxazole_count
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- name: 1,2,4-dioxazole_count
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- name: 1,3,2-dioxazole_count
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- name: 1,3,4-dioxazole_count
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- name: 5H-1,2,5-oxathiazole_count
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- name: 1,3-oxathiole_count
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- name: benzene_count
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- name: cyclohexane_count
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- name: 2H-pyran_count
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- name: 4H-pyran_count
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- name: 2H-pyran-2-one_count
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- name: 4H-pyran-4-one_count
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- name: 1,2-dioxin_count
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- name: 1,3-dioxin_count
dtype: int64
- name: pyridine_count
dtype: int64
- name: pyridazine_count
dtype: int64
- name: pyrimidine_count
dtype: int64
- name: pyrazine_count
dtype: int64
- name: piperazine_count
dtype: int64
- name: 1,3,5-triazine_count
dtype: int64
- name: 1,2,4-triazine_count
dtype: int64
- name: 1,2,3-triazine_count
dtype: int64
- name: 4H-1,2-Oxazine_count
dtype: int64
- name: 2H-1,3-Oxazine_count
dtype: int64
- name: 6H-1,3-Oxazine_count
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- name: 6H-1,2-Oxazine_count
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- name: 1,4-Oxazine_count
dtype: int64
- name: 2H-1,2-Oxazine_count
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- name: 4H-1,4-Oxazine_count
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- name: 1,2,5-Oxathiazine_count
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- name: 1,2,6-Oxathiazine_count
dtype: int64
- name: 1,2,4-Oxadiazine_count
dtype: int64
- name: 1,3,5-Oxadiazine_count
dtype: int64
- name: morpholine_count
dtype: int64
- name: azepine_count
dtype: int64
- name: oxepin_count
dtype: int64
- name: thiepin_count
dtype: int64
- name: 4H-1,2-diazepine_count
dtype: int64
- name: indene_count
dtype: int64
- name: 2H-indene_count
dtype: int64
- name: benzofuran_count
dtype: int64
- name: isobenzofuran_count
dtype: int64
- name: benzo[b]thiophene_count
dtype: int64
- name: benzo[c]thiophene_count
dtype: int64
- name: indole_count
dtype: int64
- name: 3H-indole_count
dtype: int64
- name: 1H-indole_count
dtype: int64
- name: cyclopenta[b]pyridine_count
dtype: int64
- name: pyrano[3,4-b]-pyrrole_count
dtype: int64
- name: indazole_count
dtype: int64
- name: benzisoxazole_count
dtype: int64
- name: benzoxazole_count
dtype: int64
- name: 2,1-benzisoxazole_count
dtype: int64
- name: naphthalene_count
dtype: int64
- name: 1,2,3,4-tetrahydronaphthalene_count
dtype: int64
- name: octahydronaphthalene_count
dtype: int64
- name: 2H-1-benzopyran_count
dtype: int64
- name: 2H-1-benzopyran-2-one_count
dtype: int64
- name: 4H-1-benzopyran-4-one_count
dtype: int64
- name: 1H-2-benzopyran-1-one_count
dtype: int64
- name: 3H-2-benzopyran-1-one_count
dtype: int64
- name: quinoline_count
dtype: int64
- name: isoquinoline_count
dtype: int64
- name: cinnoline_count
dtype: int64
- name: quinazoline_count
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- name: 1,8-napthyhridine_count
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- name: 1,7-napththyridine_count
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- name: 1,5-napththridine_count
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- name: 1,6-napthyridine_count
dtype: int64
- name: 2H-1,3-benzoxazine_count
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- name: 2H-1,4-benzoxazine_count
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- name: 1H-2,3-benzoxazine_count
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- name: 4H-3,1-benzoxazine_count
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- name: 2H-1,2-benzoxazine_count
dtype: int64
- name: 4H-1,3-benzoxazine_count
dtype: int64
- name: anthracene_count
dtype: int64
- name: phenanthrene_count
dtype: int64
- name: phenalene_count
dtype: int64
- name: fluorene_count
dtype: int64
- name: carbazole_count
dtype: int64
- name: xanthene_count
dtype: int64
- name: acridine_count
dtype: int64
- name: norpinane_count
dtype: int64
- name: 7H-purine_count
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- name: steroid_ring_system_count
dtype: int64
- name: imidazole_count
dtype: int64
- name: thiazol-2-amine_count
dtype: int64
- name: tetrazole_count
dtype: int64
- name: cytosine_count
dtype: int64
- name: adenine_count
dtype: int64
- name: 5-methylindole_count
dtype: int64
- name: isocaffeine_count
dtype: int64
- name: tetrazolethiol_count
dtype: int64
- name: 3-methylisoxazole_count
dtype: int64
- name: 1-methylimidazole_count
dtype: int64
- name: 2-methylimidazole_count
dtype: int64
- name: guanine_count
dtype: int64
- name: tosufloxacin_count
dtype: int64
- name: acetamido_count
dtype: int64
- name: acetoacetyl_count
dtype: int64
- name: acetyl_count
dtype: int64
- name: acryloyl_count
dtype: int64
- name: alanyl_count
dtype: int64
- name: beta-alanyl_count
dtype: int64
- name: allylidene_count
dtype: int64
- name: amidino_count
dtype: int64
- name: amino_count
dtype: int64
- name: amyl_count
dtype: int64
- name: anilino_count
dtype: int64
- name: anisidino_count
dtype: int64
- name: anthranoyl_count
dtype: int64
- name: arsino_count
dtype: int64
- name: azelaoyl_count
dtype: int64
- name: azido_count
dtype: int64
- name: azo_count
dtype: int64
- name: azoxy_count
dtype: int64
- name: benzal_count
dtype: int64
- name: benzamido_count
dtype: int64
- name: benzhydrol_count
dtype: int64
- name: benzoxy_count
dtype: int64
- name: benzoyl_count
dtype: int64
- name: benzylidene_count
dtype: int64
- name: benzylidyne_count
dtype: int64
- name: biphenylyl_count
dtype: int64
- name: biphenylene_count
dtype: int64
- name: butoxy_count
dtype: int64
- name: sec-butoxy_count
dtype: int64
- name: tert-butoxy_count
dtype: int64
- name: butyl_count
dtype: int64
- name: sec-butyl_count
dtype: int64
- name: butyryl_count
dtype: int64
- name: caproyl_count
dtype: int64
- name: capryl_count
dtype: int64
- name: capryloyl_count
dtype: int64
- name: carbamido_count
dtype: int64
- name: carbamoyl_count
dtype: int64
- name: carbamyl_count
dtype: int64
- name: carbazoyl_count
dtype: int64
- name: carbethoxy_count
dtype: int64
- name: carbonyl_count
dtype: int64
- name: carboxy_count
dtype: int64
- name: cetyl_count
dtype: int64
- name: chloroformyl_count
dtype: int64
- name: cinnamoyl_count
dtype: int64
- name: cinnamyl_count
dtype: int64
- name: cinnamylidene_count
dtype: int64
- name: cresyl_count
dtype: int64
- name: crotonoyl_count
dtype: int64
- name: crotyl_count
dtype: int64
- name: cyanamido_count
dtype: int64
- name: cyanato_count
dtype: int64
- name: cyano_count
dtype: int64
- name: decanedioyl_count
dtype: int64
- name: decanoyl_count
dtype: int64
- name: diazo_count
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- name: diazoamino_count
dtype: int64
- name: disilanyl_count
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- name: disiloxanyloxy_count
dtype: int64
- name: disulfinyl_count
dtype: int64
- name: dithio_count
dtype: int64
- name: enanthoyl_count
dtype: int64
- name: epoxy_count
dtype: int64
- name: ethenyl_count
dtype: int64
- name: ethynyl_count
dtype: int64
- name: ethoxy_count
dtype: int64
- name: ethylene_count
dtype: int64
- name: ethylidene_count
dtype: int64
- name: ethylthio_count
dtype: int64
- name: formamido_count
dtype: int64
- name: furmaroyl_count
dtype: int64
- name: furfuryl_count
dtype: int64
- name: furfurylidene_count
dtype: int64
- name: glutamoyl_count
dtype: int64
- name: glutaryl_count
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- name: glycylamino_count
dtype: int64
- name: glycoloyl_count
dtype: int64
- name: glycyl_count
dtype: int64
- name: glyoxyoyl_count
dtype: int64
- name: guanidino_count
dtype: int64
- name: guanyl_count
dtype: int64
- name: heptadecanoyl_count
dtype: int64
- name: heptanamido_count
dtype: int64
- name: heptanoyl_count
dtype: int64
- name: hexadecanoyl_count
dtype: int64
- name: hexamethylene_count
dtype: int64
- name: hexanedioyl_count
dtype: int64
- name: hippuryl_count
dtype: int64
- name: hydrazino_count
dtype: int64
- name: hydrazo_count
dtype: int64
- name: hydrocinnamoyl_count
dtype: int64
- name: hydroperoxy_count
dtype: int64
- name: hydroxyamino_count
dtype: int64
- name: imino_count
dtype: int64
- name: iodoso_count
dtype: int64
- name: iodyl_count
dtype: int64
- name: isoamyl_count
dtype: int64
- name: isobutenyl_count
dtype: int64
- name: isobutoxy_count
dtype: int64
- name: isobutyl_count
dtype: int64
- name: isobutylidene_count
dtype: int64
- name: isobutyryl_count
dtype: int64
- name: isocyanato_count
dtype: int64
- name: isocyano_count
dtype: int64
- name: isohexyl_count
dtype: int64
- name: isoleucyl_count
dtype: int64
- name: isonitroso_count
dtype: int64
- name: isopentyl_count
dtype: int64
- name: isopentylidene_count
dtype: int64
- name: isopropenyl_count
dtype: int64
- name: isopropoxy_count
dtype: int64
- name: isopropyl_count
dtype: int64
- name: isopropylidene_count
dtype: int64
- name: isothiocynato_count
dtype: int64
- name: isovaleryl_count
dtype: int64
- name: lactoyl_count
dtype: int64
- name: lauroyl_count
dtype: int64
- name: lauryl_count
dtype: int64
- name: leucyl_count
dtype: int64
- name: levulinoyl_count
dtype: int64
- name: malonyl_count
dtype: int64
- name: mandeloyl_count
dtype: int64
- name: mercapto_count
dtype: int64
- name: mesityl_count
dtype: int64
- name: methacryloyl_count
dtype: int64
- name: methallyl_count
dtype: int64
- name: methionyl_count
dtype: int64
- name: methoxy_count
dtype: int64
- name: methylene_count
dtype: int64
- name: methylthio_count
dtype: int64
- name: myristoyl_count
dtype: int64
- name: myristyl_count
dtype: int64
- name: naphthyl_count
dtype: int64
- name: naphthylene_count
dtype: int64
- name: neopentyl_count
dtype: int64
- name: nitramino_count
dtype: int64
- name: nitrosamino_count
dtype: int64
- name: nitroso_count
dtype: int64
- name: nonanoyl_count
dtype: int64
- name: oleoyl_count
dtype: int64
- name: oxalyl_count
dtype: int64
- name: oxo_count
dtype: int64
- name: palmitoyl_count
dtype: int64
- name: pentamethylene_count
dtype: int64
- name: pentyl_count
dtype: int64
- name: tert-pentyl_count
dtype: int64
- name: phenacylidene_count
dtype: int64
- name: phenethyl_count
dtype: int64
- name: phenoxy_count
dtype: int64
- name: phenyl_count
dtype: int64
- name: phenylene_count
dtype: int64
- name: phosphino_count
dtype: int64
- name: phosphinyl_count
dtype: int64
- name: phospho_count
dtype: int64
- name: phosphono_count
dtype: int64
- name: phthaloyl_count
dtype: int64
- name: picryl_count
dtype: int64
- name: pimeloyl_count
dtype: int64
- name: piperidino_count
dtype: int64
- name: pivaloyl_count
dtype: int64
- name: prenyl_count
dtype: int64
- name: propargyl_count
dtype: int64
- name: 1-propenyl_count
dtype: int64
- name: 2-propenyl_count
dtype: int64
- name: propionyl_count
dtype: int64
- name: propoxy_count
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- name: propyl_count
dtype: int64
- name: propylidene_count
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- name: pyrryl_count
dtype: int64
- name: salicyloyl_count
dtype: int64
- name: selenyl_count
dtype: int64
- name: seryl_count
dtype: int64
- name: siloxy_count
dtype: int64
- name: silyl_count
dtype: int64
- name: silyene_count
dtype: int64
- name: sorboyl_count
dtype: int64
- name: stearoyl_count
dtype: int64
- name: stearyl_count
dtype: int64
- name: styryl_count
dtype: int64
- name: suberoyl_count
dtype: int64
- name: succinyl_count
dtype: int64
- name: sulfamino_count
dtype: int64
- name: sulfamoyl_count
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- name: sulfanilyl_count
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- name: sulfeno_count
dtype: int64
- name: sulfhydryl_count
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- name: sulfinyl_count
dtype: int64
- name: sulfo_count
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- name: sulfonyl_count
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- name: terephthaloyl_count
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- name: tetramethylene_count
dtype: int64
- name: thienyl_count
dtype: int64
- name: thiocarbonyl_count
dtype: int64
- name: thiocarboxy_count
dtype: int64
- name: thiocyanato_count
dtype: int64
- name: thionyl_count
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- name: threonyl_count
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- name: toluidino_count
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- name: toluoyl_count
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- name: tolyl_count
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- name: alpha-tolyl_count
dtype: int64
- name: tolylene_count
dtype: int64
- name: tosyl_count
dtype: int64
- name: triazano_count
dtype: int64
- name: trimethylene_count
dtype: int64
- name: valeryl_count
dtype: int64
- name: valyl_count
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- name: vinyl_count
dtype: int64
- name: vinylidene_count
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- name: xylidino_count
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- name: xylyl_count
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- name: xylylene_count
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- name: propiolamide_count
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- name: fumarate ester_count
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- name: allenamide_count
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- name: propiolonitrile_count
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- name: propargylamide_count
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- name: arylsulfonyl bicyclobutane_count
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- name: haloalkane_count
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- name: alpha-halomethyl_count
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- name: alpha-haloamide_count
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- name: alpha-haloester_count
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- name: epoxide_count
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- name: aziridine_count
dtype: int64
- name: nitroalkane_count
dtype: int64
- name: acrylamide_count
dtype: int64
- name: cyanoenone_count
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- name: aldehyde_count
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- name: ketone_count
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- name: nitrile_count
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- name: cyanamide_count
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- name: isothicyanate_count
dtype: int64
- name: sulfone_count
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- name: sulfonyl fluoride_count
dtype: int64
- name: sulfonimidoyl fluoride_count
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- name: aryl fluorosulfate_count
dtype: int64
- name: ester_count
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- name: sulfonamide_count
dtype: int64
- name: 2-carbonyl arylboronic acid_count
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- name: n-methyl isoxazolium_count
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- name: halogen_count
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- name: amine_count
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- name: amide_count
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- name: num_valence_electrons
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- name: num_hydrogen_bonds
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- name: num_hydrogen_atoms
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- name: num_nitrogen_atoms
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- name: num_oxygen_atoms
dtype: int64
- name: num_hydrogen_bond_acceptors
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- name: num_hydrogen_bond_donors
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- name: num_lipinski_violations
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- name: inertial_shape_factor
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- name: eccentricity
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- name: asphericity
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- name: pmi2_value
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- name: pmi3_value
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- name: num_chiral_centers
dtype: int64
- name: representation
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splits:
- name: train
num_bytes: 2760228
num_examples: 499
download_size: 518564
dataset_size: 2760228
- config_name: rdkit_feat_11
features:
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dtype: int64
- name: representation_type
dtype: string
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dtype: int64
- name: 3,5-dimethoxyphenylisoproxycarbonyl_count
dtype: int64
- name: 2-(4-biphenyl)isopropoxycarbonyl_count
dtype: int64
- name: 2-nitrophenylsulfenyl_count
dtype: int64
- name: boc_count
dtype: int64
- name: trt_count
dtype: int64
- name: ddz_count
dtype: int64
- name: bpoc_count
dtype: int64
- name: nps_count
dtype: int64
- name: 9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: 2-(4-nitrophenylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: (1,1-dioxobenzo[b]thiophene-2-yl)methyloxycarbonyl_count
dtype: int64
- name: (1,1-dioxonaptho[1,2-b]thiophene-2-yl)methyloxycarbonyl_count
dtype: int64
- name: 1-(4,4-dimethyl-2,6-dioxocyclohex-1-ylidene)-3-methylbutyl_count
dtype: int64
- name: 2,7-di-tert-butyl-fmoc_count
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- name: 2-fluoro-fmoc_count
dtype: int64
- name: 2-monoisooctyl-fmoc_count
dtype: int64
- name: 2,7-diisooctyl-fmoc_count
dtype: int64
- name: tetrachlorophthaloyl_count
dtype: int64
- name: 2-[phenyl(methyl)sulfonio])ethyloxycarbonyltetrafluoroborate_count
dtype: int64
- name: ethanesulfonylethoxycarbonyl_count
dtype: int64
- name: 2-(4-sulfophenylsulfonyl)ethoxycarbonyl_count
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- name: fmoc_count
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- name: nsc_count
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- name: bsmoc_count
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- name: alpha-nsmoc_count
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- name: ivdde_count
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- name: fmoc*_count
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- name: fmoc(fmoc(2f))_count
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- name: mio-fmoc_count
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- name: dio-fmoc_count
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- name: tcp_count
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- name: pms_count
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- name: esc_count
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- name: sps_count
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- name: benzyloxycarbonyl_count
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- name: allyloxycarbonyl_count
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- name: o-nitrobenzenesulfonyl_count
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- name: 2,4-dinitrobenzenesulfonyl_count
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- name: benzothiazole-2-sulfonyl_count
dtype: int64
- name: 2,2,2-trichloroethyloxycarbonyl_count
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- name: dithiasuccinoyl_count
dtype: int64
- name: p-nitrobenzyloxycarbonyl_count
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- name: alpha-azidoacids_count
dtype: int64
- name: proparglyoxycarbonyl_count
dtype: int64
- name: o-nitrobenzylcarbonyl_count
dtype: int64
- name: 4-nitroveratryloxycarbonyl_count
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- name: 2-(2-nitrophenyl)propyloxycarbonyl_count
dtype: int64
- name: 2-(3,4-methylenedioxy-6-nitrophenyl)propyloxycarbonyl_count
dtype: int64
- name: 9-(4-bromophenyl)-9-fluorenyl_count
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- name: azidomethoxycarbonyl_count
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- name: hexafluoroacetone_count
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- name: Z_count
dtype: int64
- name: alloc_count
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- name: o-nbs_count
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- name: d-nbs_count
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- name: bts_count
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- name: troc_count
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- name: dts_count
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- name: pnz_count
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- name: poc_count
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- name: onz_count
dtype: int64
- name: nvoc_count
dtype: int64
- name: nppoc_count
dtype: int64
- name: mnppoc_count
dtype: int64
- name: brphf_count
dtype: int64
- name: azoc_count
dtype: int64
- name: hfa_count
dtype: int64
- name: 2-chlorobenzyloxycarbonyl_count
dtype: int64
- name: 4-methyltrityl_count
dtype: int64
- name: cl-z_count
dtype: int64
- name: mtt_count
dtype: int64
- name: 1-(4,4-dimethyl-2,6-dioxocylohex-1-ylidene)-3-methylbutyl_count
dtype: int64
- name: trifluoroacetyl_count
dtype: int64
- name: 2-(methylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: tfa_count
dtype: int64
- name: msc_count
dtype: int64
- name: phenyldisulphanylethyloxycarbonyl_count
dtype: int64
- name: 2-pyridyldisulphanylethyloxycarbonyl_count
dtype: int64
- name: phdec_count
dtype: int64
- name: pydec_count
dtype: int64
- name: tert-butyl_count
dtype: int64
- name: 2-chlorotrityl_count
dtype: int64
- name: 2-4-dimethyoxybenzyl_count
dtype: int64
- name: 2-phenylisopropyl_count
dtype: int64
- name: 5-phenyl-3,4-ethylenedioxythenyl_count
dtype: int64
- name: bu_count
dtype: int64
- name: 2-cl-trt_count
dtype: int64
- name: dmb_count
dtype: int64
- name: 2-ph-pr_count
dtype: int64
- name: phenyl-edotn_count
dtype: int64
- name: 9-fluorenylmethyl_count
dtype: int64
- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocylocheylidene)-3-methylbutyl]-amino)benzyl_count
dtype: int64
- name: methyl_count
dtype: int64
- name: ethyl_count
dtype: int64
- name: carbamoylmethyl_count
dtype: int64
- name: fm_count
dtype: int64
- name: dmab_count
dtype: int64
- name: me_count
dtype: int64
- name: et_count
dtype: int64
- name: cam_count
dtype: int64
- name: allyl_count
dtype: int64
- name: benzyl_count
dtype: int64
- name: phenacyl_count
dtype: int64
- name: p-nitrobenzyl_count
dtype: int64
- name: 2-trimethylsilyethyl_count
dtype: int64
- name: (2-phenyl-2-trimethylsilyl)ethyl_count
dtype: int64
- name: 2-(trimethylsilyl)isopropyl_count
dtype: int64
- name: 2,2,2-trichloroethyl_count
dtype: int64
- name: p-hydroxyphenacyl_count
dtype: int64
- name: 4,5-dimethyoxy-2-nitrobenzyl_count
dtype: int64
- name: 1,1-dimethylallyl_count
dtype: int64
- name: pentaaminecobalt_III_count
dtype: int64
- name: al_count
dtype: int64
- name: bn_count
dtype: int64
- name: pac_count
dtype: int64
- name: pnb_count
dtype: int64
- name: tmse_count
dtype: int64
- name: ptmse_count
dtype: int64
- name: tmsi_count
dtype: int64
- name: tce_count
dtype: int64
- name: php_count
dtype: int64
- name: dmnb_count
dtype: int64
- name: dma_count
dtype: int64
- name: cyclohexyl_count
dtype: int64
- name: b-menthyl_count
dtype: int64
- name: b-3-methylpent-3-yl_count
dtype: int64
- name: 4-(3,6,9-trioxadecyl)oxybenzyl_count
dtype: int64
- name: chx_count
dtype: int64
- name: men_count
dtype: int64
- name: mpe_count
dtype: int64
- name: tegbz_count
dtype: int64
- name: 9-fluoroenylmethyl_count
dtype: int64
- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-methyl-butyl]-amino)benzyl_count
dtype: int64
- name: trimethylsilylethyl_count
dtype: int64
- name: 4,5-dimethoxy-2-nitrobenzyloxycarbonyl_count
dtype: int64
- name: pseudoprolines_count
dtype: int64
- name: 2-hydroxy-4-methoxybenzyl_count
dtype: int64
- name: 2,4-dimethoxybenzyl_count
dtype: int64
- name: 2,4,6-trimethoxybenzyl_count
dtype: int64
- name: 1-methyl-3-indolylmethyl_count
dtype: int64
- name: 3,4-ethylene-dioxy-2-thenyl_count
dtype: int64
- name: hmb_count
dtype: int64
- name: tmob_count
dtype: int64
- name: mim_count
dtype: int64
- name: edot_count
dtype: int64
- name: 4-methoxy-2-nitro-benzyl_count
dtype: int64
- name: (6-hydroxy-3-oxido-1,3-benz[d]oxathiol-5-yl)methyl_count
dtype: int64
- name: 2-hydroxy-4-methoxy-5-(methylsulfinyl)benzyl_count
dtype: int64
- name: n-boc-n-methyl[2-(methylamino)ethyl]carbamoyl-hmb_count
dtype: int64
- name: 9-xanthenyl_count
dtype: int64
- name: cyclopropyldimethylcarbinyl_count
dtype: int64
- name: 4,4-dimethoxybenzhydryl_count
dtype: int64
- name: xan_count
dtype: int64
- name: cpd_count
dtype: int64
- name: mbh_count
dtype: int64
- name: p-toluenesulfonyl_count
dtype: int64
- name: 2,2,5,7,8-pentamethylchroman-6-sulfonyl_count
dtype: int64
- name: 2,2,4,6,7-pentamethyl-2,3-dihydrobenzofuran-5-sulfonyl_count
dtype: int64
- name: mesityl-2-sulfonyl_count
dtype: int64
- name: 4-methoxy-2,3,6-trimethylphenylsulfonyl_count
dtype: int64
- name: 1,2-dimethylindole-3-sulfonyl_count
dtype: int64
- name: w,w-bis-tert-butyloxycarbonyl_count
dtype: int64
- name: 5-dibenzosuberenyl_count
dtype: int64
- name: 5-dibenzosuberyl_count
dtype: int64
- name: 2-methoxy-5-dibenzosuberyl_count
dtype: int64
- name: nitro_count
dtype: int64
- name: tos_count
dtype: int64
- name: pmc_count
dtype: int64
- name: pbf_count
dtype: int64
- name: mts_count
dtype: int64
- name: mtr_count
dtype: int64
- name: mis_count
dtype: int64
- name: bis-boc_count
dtype: int64
- name: suben_count
dtype: int64
- name: sub_count
dtype: int64
- name: mesub_count
dtype: int64
- name: no2_count
dtype: int64
- name: w,w-bis-benzyloxycarbonyl_count
dtype: int64
- name: w,w-bis-allyloxycarbonyl_count
dtype: int64
- name: z-small_count
dtype: int64
- name: p-methylbenzyl_count
dtype: int64
- name: p-methoxybenzyl_count
dtype: int64
- name: monomethoxytrityl_count
dtype: int64
- name: trimethoxybenzyl_count
dtype: int64
- name: 2,2,4,6,7-pentamethyl-5-dihydrobenzofuranylmethyl_count
dtype: int64
- name: 1-adamantyl_count
dtype: int64
- name: meb_count
dtype: int64
- name: mob_count
dtype: int64
- name: mmt_count
dtype: int64
- name: pmbf_count
dtype: int64
- name: 1-ada_count
dtype: int64
- name: 2-(2,4-dinitrophenyl)ethyl_count
dtype: int64
- name: 9-fluororenylmethoxycarbonyl_count
dtype: int64
- name: dnpe_count
dtype: int64
- name: acetamidomethyl_count
dtype: int64
- name: phenylacetamidomethyl_count
dtype: int64
- name: 5-tert-butylmercapto_count
dtype: int64
- name: 3-nitro-2-pyridinesulfenyl_count
dtype: int64
- name: 2-pyridinesulfenyl_count
dtype: int64
- name: N-allyloxycarbonyl-N-[2,3,5,6-tetrafluoro-4-(phenylthio)phenyl]]aminomethyl_count
dtype: int64
- name: o-nitrobenzyl_count
dtype: int64
- name: 4-picolyl_count
dtype: int64
- name: ninhydrin_count
dtype: int64
- name: acm_count
dtype: int64
- name: phacm_count
dtype: int64
- name: sbu_count
dtype: int64
- name: npys_count
dtype: int64
- name: s-pyr_count
dtype: int64
- name: fsam_count
dtype: int64
- name: onb_count
dtype: int64
- name: nin_count
dtype: int64
- name: n-tosyl_count
dtype: int64
- name: n-trityl_count
dtype: int64
- name: n-monomethoxytrityl_count
dtype: int64
- name: n-methyltrityl_count
dtype: int64
- name: n-tert-butyloxycarbonyl_count
dtype: int64
- name: n-2,4-dimethylpent-3-yloxycarbonyl_count
dtype: int64
- name: n-benzyloxymethyl_count
dtype: int64
- name: n-tert-butoxymethyl_count
dtype: int64
- name: ntos_count
dtype: int64
- name: ntrt_count
dtype: int64
- name: nmtt_count
dtype: int64
- name: nmmt_count
dtype: int64
- name: nboc_count
dtype: int64
- name: ndoc_count
dtype: int64
- name: nbom_count
dtype: int64
- name: nbum_count
dtype: int64
- name: N-9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: N-2,6-dimethoxybenzoyl_count
dtype: int64
- name: dmbz_count
dtype: int64
- name: N-2,4-dinitrophenyl_count
dtype: int64
- name: dnp_count
dtype: int64
- name: cyclohexyl;_count
dtype: int64
- name: tert-butyldimethylsilyl_count
dtype: int64
- name: tbdms_count
dtype: int64
- name: tert-butyldiphenylsilyl_count
dtype: int64
- name: propargyloxycarbonyl_count
dtype: int64
- name: tbdps_count
dtype: int64
- name: 2,6-dichlorobenzyl_count
dtype: int64
- name: 2-bromobenzyl_count
dtype: int64
- name: 2-bromobenzyloxycarbonyl_count
dtype: int64
- name: 3-pentyl_count
dtype: int64
- name: dcb_count
dtype: int64
- name: brbn_count
dtype: int64
- name: brz_count
dtype: int64
- name: pen_count
dtype: int64
- name: tegb_count
dtype: int64
- name: boc-n-methyl-n-[2-(methylamino)ethyl]carbamoyl_count
dtype: int64
- name: boc-nmec_count
dtype: int64
- name: formyl_count
dtype: int64
- name: cyclohexyloxycarbonyl_count
dtype: int64
- name: for_count
dtype: int64
- name: hoc_count
dtype: int64
- name: cyclopropane_count
dtype: int64
- name: spiropentane_count
dtype: int64
- name: cyclobutane_count
dtype: int64
- name: cyclopentane_count
dtype: int64
- name: furan_count
dtype: int64
- name: thiophene_count
dtype: int64
- name: pyrrole_count
dtype: int64
- name: 2H-pyrrole_count
dtype: int64
- name: 3H-pyrrole_count
dtype: int64
- name: pyrazole_count
dtype: int64
- name: 2H-imidazole_count
dtype: int64
- name: 1,2,3-triazole_count
dtype: int64
- name: 1,2,4-triazole_count
dtype: int64
- name: 1,2-dithiole_count
dtype: int64
- name: 1,3-dithiole_count
dtype: int64
- name: 3H-1,2-oxathiole_count
dtype: int64
- name: isoxazole_count
dtype: int64
- name: oxazole_count
dtype: int64
- name: thiazole_count
dtype: int64
- name: isothiazole_count
dtype: int64
- name: 1,2,3-oxadiazole_count
dtype: int64
- name: 1,2,4-oxadiazole_count
dtype: int64
- name: 1,2,5-oxadiazole_count
dtype: int64
- name: 1,3,4-oxadiazole_count
dtype: int64
- name: 1,2,3,4-oxatriazole_count
dtype: int64
- name: 1,2,3,5-oxatriazole_count
dtype: int64
- name: 3H-1,2,3-dioxazole_count
dtype: int64
- name: 1,2,4-dioxazole_count
dtype: int64
- name: 1,3,2-dioxazole_count
dtype: int64
- name: 1,3,4-dioxazole_count
dtype: int64
- name: 5H-1,2,5-oxathiazole_count
dtype: int64
- name: 1,3-oxathiole_count
dtype: int64
- name: benzene_count
dtype: int64
- name: cyclohexane_count
dtype: int64
- name: 2H-pyran_count
dtype: int64
- name: 4H-pyran_count
dtype: int64
- name: 2H-pyran-2-one_count
dtype: int64
- name: 4H-pyran-4-one_count
dtype: int64
- name: 1,2-dioxin_count
dtype: int64
- name: 1,3-dioxin_count
dtype: int64
- name: pyridine_count
dtype: int64
- name: pyridazine_count
dtype: int64
- name: pyrimidine_count
dtype: int64
- name: pyrazine_count
dtype: int64
- name: piperazine_count
dtype: int64
- name: 1,3,5-triazine_count
dtype: int64
- name: 1,2,4-triazine_count
dtype: int64
- name: 1,2,3-triazine_count
dtype: int64
- name: 4H-1,2-Oxazine_count
dtype: int64
- name: 2H-1,3-Oxazine_count
dtype: int64
- name: 6H-1,3-Oxazine_count
dtype: int64
- name: 6H-1,2-Oxazine_count
dtype: int64
- name: 1,4-Oxazine_count
dtype: int64
- name: 2H-1,2-Oxazine_count
dtype: int64
- name: 4H-1,4-Oxazine_count
dtype: int64
- name: 1,2,5-Oxathiazine_count
dtype: int64
- name: 1,2,6-Oxathiazine_count
dtype: int64
- name: 1,2,4-Oxadiazine_count
dtype: int64
- name: 1,3,5-Oxadiazine_count
dtype: int64
- name: morpholine_count
dtype: int64
- name: azepine_count
dtype: int64
- name: oxepin_count
dtype: int64
- name: thiepin_count
dtype: int64
- name: 4H-1,2-diazepine_count
dtype: int64
- name: indene_count
dtype: int64
- name: 2H-indene_count
dtype: int64
- name: benzofuran_count
dtype: int64
- name: isobenzofuran_count
dtype: int64
- name: benzo[b]thiophene_count
dtype: int64
- name: benzo[c]thiophene_count
dtype: int64
- name: indole_count
dtype: int64
- name: 3H-indole_count
dtype: int64
- name: 1H-indole_count
dtype: int64
- name: cyclopenta[b]pyridine_count
dtype: int64
- name: pyrano[3,4-b]-pyrrole_count
dtype: int64
- name: indazole_count
dtype: int64
- name: benzisoxazole_count
dtype: int64
- name: benzoxazole_count
dtype: int64
- name: 2,1-benzisoxazole_count
dtype: int64
- name: naphthalene_count
dtype: int64
- name: 1,2,3,4-tetrahydronaphthalene_count
dtype: int64
- name: octahydronaphthalene_count
dtype: int64
- name: 2H-1-benzopyran_count
dtype: int64
- name: 2H-1-benzopyran-2-one_count
dtype: int64
- name: 4H-1-benzopyran-4-one_count
dtype: int64
- name: 1H-2-benzopyran-1-one_count
dtype: int64
- name: 3H-2-benzopyran-1-one_count
dtype: int64
- name: quinoline_count
dtype: int64
- name: isoquinoline_count
dtype: int64
- name: cinnoline_count
dtype: int64
- name: quinazoline_count
dtype: int64
- name: 1,8-napthyhridine_count
dtype: int64
- name: 1,7-napththyridine_count
dtype: int64
- name: 1,5-napththridine_count
dtype: int64
- name: 1,6-napthyridine_count
dtype: int64
- name: 2H-1,3-benzoxazine_count
dtype: int64
- name: 2H-1,4-benzoxazine_count
dtype: int64
- name: 1H-2,3-benzoxazine_count
dtype: int64
- name: 4H-3,1-benzoxazine_count
dtype: int64
- name: 2H-1,2-benzoxazine_count
dtype: int64
- name: 4H-1,3-benzoxazine_count
dtype: int64
- name: anthracene_count
dtype: int64
- name: phenanthrene_count
dtype: int64
- name: phenalene_count
dtype: int64
- name: fluorene_count
dtype: int64
- name: carbazole_count
dtype: int64
- name: xanthene_count
dtype: int64
- name: acridine_count
dtype: int64
- name: norpinane_count
dtype: int64
- name: 7H-purine_count
dtype: int64
- name: steroid_ring_system_count
dtype: int64
- name: imidazole_count
dtype: int64
- name: thiazol-2-amine_count
dtype: int64
- name: tetrazole_count
dtype: int64
- name: cytosine_count
dtype: int64
- name: adenine_count
dtype: int64
- name: 5-methylindole_count
dtype: int64
- name: isocaffeine_count
dtype: int64
- name: tetrazolethiol_count
dtype: int64
- name: 3-methylisoxazole_count
dtype: int64
- name: 1-methylimidazole_count
dtype: int64
- name: 2-methylimidazole_count
dtype: int64
- name: guanine_count
dtype: int64
- name: tosufloxacin_count
dtype: int64
- name: acetamido_count
dtype: int64
- name: acetoacetyl_count
dtype: int64
- name: acetyl_count
dtype: int64
- name: acryloyl_count
dtype: int64
- name: alanyl_count
dtype: int64
- name: beta-alanyl_count
dtype: int64
- name: allylidene_count
dtype: int64
- name: amidino_count
dtype: int64
- name: amino_count
dtype: int64
- name: amyl_count
dtype: int64
- name: anilino_count
dtype: int64
- name: anisidino_count
dtype: int64
- name: anthranoyl_count
dtype: int64
- name: arsino_count
dtype: int64
- name: azelaoyl_count
dtype: int64
- name: azido_count
dtype: int64
- name: azo_count
dtype: int64
- name: azoxy_count
dtype: int64
- name: benzal_count
dtype: int64
- name: benzamido_count
dtype: int64
- name: benzhydrol_count
dtype: int64
- name: benzoxy_count
dtype: int64
- name: benzoyl_count
dtype: int64
- name: benzylidene_count
dtype: int64
- name: benzylidyne_count
dtype: int64
- name: biphenylyl_count
dtype: int64
- name: biphenylene_count
dtype: int64
- name: butoxy_count
dtype: int64
- name: sec-butoxy_count
dtype: int64
- name: tert-butoxy_count
dtype: int64
- name: butyl_count
dtype: int64
- name: sec-butyl_count
dtype: int64
- name: butyryl_count
dtype: int64
- name: caproyl_count
dtype: int64
- name: capryl_count
dtype: int64
- name: capryloyl_count
dtype: int64
- name: carbamido_count
dtype: int64
- name: carbamoyl_count
dtype: int64
- name: carbamyl_count
dtype: int64
- name: carbazoyl_count
dtype: int64
- name: carbethoxy_count
dtype: int64
- name: carbonyl_count
dtype: int64
- name: carboxy_count
dtype: int64
- name: cetyl_count
dtype: int64
- name: chloroformyl_count
dtype: int64
- name: cinnamoyl_count
dtype: int64
- name: cinnamyl_count
dtype: int64
- name: cinnamylidene_count
dtype: int64
- name: cresyl_count
dtype: int64
- name: crotonoyl_count
dtype: int64
- name: crotyl_count
dtype: int64
- name: cyanamido_count
dtype: int64
- name: cyanato_count
dtype: int64
- name: cyano_count
dtype: int64
- name: decanedioyl_count
dtype: int64
- name: decanoyl_count
dtype: int64
- name: diazo_count
dtype: int64
- name: diazoamino_count
dtype: int64
- name: disilanyl_count
dtype: int64
- name: disiloxanyloxy_count
dtype: int64
- name: disulfinyl_count
dtype: int64
- name: dithio_count
dtype: int64
- name: enanthoyl_count
dtype: int64
- name: epoxy_count
dtype: int64
- name: ethenyl_count
dtype: int64
- name: ethynyl_count
dtype: int64
- name: ethoxy_count
dtype: int64
- name: ethylene_count
dtype: int64
- name: ethylidene_count
dtype: int64
- name: ethylthio_count
dtype: int64
- name: formamido_count
dtype: int64
- name: furmaroyl_count
dtype: int64
- name: furfuryl_count
dtype: int64
- name: furfurylidene_count
dtype: int64
- name: glutamoyl_count
dtype: int64
- name: glutaryl_count
dtype: int64
- name: glycylamino_count
dtype: int64
- name: glycoloyl_count
dtype: int64
- name: glycyl_count
dtype: int64
- name: glyoxyoyl_count
dtype: int64
- name: guanidino_count
dtype: int64
- name: guanyl_count
dtype: int64
- name: heptadecanoyl_count
dtype: int64
- name: heptanamido_count
dtype: int64
- name: heptanoyl_count
dtype: int64
- name: hexadecanoyl_count
dtype: int64
- name: hexamethylene_count
dtype: int64
- name: hexanedioyl_count
dtype: int64
- name: hippuryl_count
dtype: int64
- name: hydrazino_count
dtype: int64
- name: hydrazo_count
dtype: int64
- name: hydrocinnamoyl_count
dtype: int64
- name: hydroperoxy_count
dtype: int64
- name: hydroxyamino_count
dtype: int64
- name: imino_count
dtype: int64
- name: iodoso_count
dtype: int64
- name: iodyl_count
dtype: int64
- name: isoamyl_count
dtype: int64
- name: isobutenyl_count
dtype: int64
- name: isobutoxy_count
dtype: int64
- name: isobutyl_count
dtype: int64
- name: isobutylidene_count
dtype: int64
- name: isobutyryl_count
dtype: int64
- name: isocyanato_count
dtype: int64
- name: isocyano_count
dtype: int64
- name: isohexyl_count
dtype: int64
- name: isoleucyl_count
dtype: int64
- name: isonitroso_count
dtype: int64
- name: isopentyl_count
dtype: int64
- name: isopentylidene_count
dtype: int64
- name: isopropenyl_count
dtype: int64
- name: isopropoxy_count
dtype: int64
- name: isopropyl_count
dtype: int64
- name: isopropylidene_count
dtype: int64
- name: isothiocynato_count
dtype: int64
- name: isovaleryl_count
dtype: int64
- name: lactoyl_count
dtype: int64
- name: lauroyl_count
dtype: int64
- name: lauryl_count
dtype: int64
- name: leucyl_count
dtype: int64
- name: levulinoyl_count
dtype: int64
- name: malonyl_count
dtype: int64
- name: mandeloyl_count
dtype: int64
- name: mercapto_count
dtype: int64
- name: mesityl_count
dtype: int64
- name: methacryloyl_count
dtype: int64
- name: methallyl_count
dtype: int64
- name: methionyl_count
dtype: int64
- name: methoxy_count
dtype: int64
- name: methylene_count
dtype: int64
- name: methylthio_count
dtype: int64
- name: myristoyl_count
dtype: int64
- name: myristyl_count
dtype: int64
- name: naphthyl_count
dtype: int64
- name: naphthylene_count
dtype: int64
- name: neopentyl_count
dtype: int64
- name: nitramino_count
dtype: int64
- name: nitrosamino_count
dtype: int64
- name: nitroso_count
dtype: int64
- name: nonanoyl_count
dtype: int64
- name: oleoyl_count
dtype: int64
- name: oxalyl_count
dtype: int64
- name: oxo_count
dtype: int64
- name: palmitoyl_count
dtype: int64
- name: pentamethylene_count
dtype: int64
- name: pentyl_count
dtype: int64
- name: tert-pentyl_count
dtype: int64
- name: phenacylidene_count
dtype: int64
- name: phenethyl_count
dtype: int64
- name: phenoxy_count
dtype: int64
- name: phenyl_count
dtype: int64
- name: phenylene_count
dtype: int64
- name: phosphino_count
dtype: int64
- name: phosphinyl_count
dtype: int64
- name: phospho_count
dtype: int64
- name: phosphono_count
dtype: int64
- name: phthaloyl_count
dtype: int64
- name: picryl_count
dtype: int64
- name: pimeloyl_count
dtype: int64
- name: piperidino_count
dtype: int64
- name: pivaloyl_count
dtype: int64
- name: prenyl_count
dtype: int64
- name: propargyl_count
dtype: int64
- name: 1-propenyl_count
dtype: int64
- name: 2-propenyl_count
dtype: int64
- name: propionyl_count
dtype: int64
- name: propoxy_count
dtype: int64
- name: propyl_count
dtype: int64
- name: propylidene_count
dtype: int64
- name: pyrryl_count
dtype: int64
- name: salicyloyl_count
dtype: int64
- name: selenyl_count
dtype: int64
- name: seryl_count
dtype: int64
- name: siloxy_count
dtype: int64
- name: silyl_count
dtype: int64
- name: silyene_count
dtype: int64
- name: sorboyl_count
dtype: int64
- name: stearoyl_count
dtype: int64
- name: stearyl_count
dtype: int64
- name: styryl_count
dtype: int64
- name: suberoyl_count
dtype: int64
- name: succinyl_count
dtype: int64
- name: sulfamino_count
dtype: int64
- name: sulfamoyl_count
dtype: int64
- name: sulfanilyl_count
dtype: int64
- name: sulfeno_count
dtype: int64
- name: sulfhydryl_count
dtype: int64
- name: sulfinyl_count
dtype: int64
- name: sulfo_count
dtype: int64
- name: sulfonyl_count
dtype: int64
- name: terephthaloyl_count
dtype: int64
- name: tetramethylene_count
dtype: int64
- name: thienyl_count
dtype: int64
- name: thiocarbonyl_count
dtype: int64
- name: thiocarboxy_count
dtype: int64
- name: thiocyanato_count
dtype: int64
- name: thionyl_count
dtype: int64
- name: threonyl_count
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- name: toluidino_count
dtype: int64
- name: toluoyl_count
dtype: int64
- name: tolyl_count
dtype: int64
- name: alpha-tolyl_count
dtype: int64
- name: tolylene_count
dtype: int64
- name: tosyl_count
dtype: int64
- name: triazano_count
dtype: int64
- name: trimethylene_count
dtype: int64
- name: valeryl_count
dtype: int64
- name: valyl_count
dtype: int64
- name: vinyl_count
dtype: int64
- name: vinylidene_count
dtype: int64
- name: xylidino_count
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- name: xylyl_count
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- name: xylylene_count
dtype: int64
- name: propiolamide_count
dtype: int64
- name: fumarate ester_count
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- name: allenamide_count
dtype: int64
- name: propiolonitrile_count
dtype: int64
- name: propargylamide_count
dtype: int64
- name: arylsulfonyl bicyclobutane_count
dtype: int64
- name: haloalkane_count
dtype: int64
- name: alpha-halomethyl_count
dtype: int64
- name: alpha-haloamide_count
dtype: int64
- name: alpha-haloester_count
dtype: int64
- name: epoxide_count
dtype: int64
- name: aziridine_count
dtype: int64
- name: nitroalkane_count
dtype: int64
- name: acrylamide_count
dtype: int64
- name: cyanoenone_count
dtype: int64
- name: aldehyde_count
dtype: int64
- name: ketone_count
dtype: int64
- name: nitrile_count
dtype: int64
- name: cyanamide_count
dtype: int64
- name: isothicyanate_count
dtype: int64
- name: sulfone_count
dtype: int64
- name: sulfonyl fluoride_count
dtype: int64
- name: sulfonimidoyl fluoride_count
dtype: int64
- name: aryl fluorosulfate_count
dtype: int64
- name: ester_count
dtype: int64
- name: sulfonamide_count
dtype: int64
- name: 2-carbonyl arylboronic acid_count
dtype: int64
- name: n-methyl isoxazolium_count
dtype: int64
- name: oxaziridine_count
dtype: int64
- name: carboxyl_count
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- name: ether_count
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- name: alkanol_count
dtype: int64
- name: thiol_count
dtype: int64
- name: halogen_count
dtype: int64
- name: amine_count
dtype: int64
- name: amide_count
dtype: int64
- name: num_valence_electrons
dtype: int64
- name: rotable_proportion
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- name: non_rotable_proportion
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- name: num_unspecified_bond
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- name: num_single_bonds
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- name: num_double_bonds
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- name: num_triple_bonds
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- name: num_quadruple_bonds
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- name: num_quintuple_bonds
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- name: num_hextuple_bonds
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- name: num_oneandahalf_bonds
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- name: num_twoandahalf_bonds
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- name: num_threeandahalf_bonds
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- name: num_fourandahalf_bonds
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- name: num_fiveandahalf_bonds
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- name: num_aromatic_bonds
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- name: num_ionic_bonds
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- name: num_hydrogen_bonds
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- name: num_threecenter_bonds
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- name: num_dativeone_bonds
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- name: num_dative_bonds
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- name: num_other_bonds
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- name: num_zero_bonds
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- name: num_bonds
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- name: molecular_formula
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- name: monoisotopic_molecular_mass
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- name: carbon_mass
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- name: hydrogen_mass
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- name: nitrogen_mass
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- name: oxygen_mass
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- name: num_carbon_atoms
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- name: num_hydrogen_atoms
dtype: int64
- name: num_nitrogen_atoms
dtype: int64
- name: num_oxygen_atoms
dtype: int64
- name: num_hydrogen_bond_acceptors
dtype: int64
- name: num_hydrogen_bond_donors
dtype: int64
- name: num_lipinski_violations
dtype: int64
- name: inertial_shape_factor
dtype: float64
- name: eccentricity
dtype: float64
- name: asphericity
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- name: npr1_value
dtype: float64
- name: npr2_value
dtype: float64
- name: pmi1_value
dtype: float64
- name: pmi2_value
dtype: float64
- name: pmi3_value
dtype: float64
- name: num_chiral_centers
dtype: int64
- name: representation
dtype: string
splits:
- name: train
num_bytes: 762717
num_examples: 138
download_size: 429594
dataset_size: 762717
- config_name: rdkit_feat_2
features:
- name: tert-butyloxycarbonyl_count
dtype: int64
- name: representation_type
dtype: string
- name: trityl_count
dtype: int64
- name: 3,5-dimethoxyphenylisoproxycarbonyl_count
dtype: int64
- name: 2-(4-biphenyl)isopropoxycarbonyl_count
dtype: int64
- name: 2-nitrophenylsulfenyl_count
dtype: int64
- name: boc_count
dtype: int64
- name: trt_count
dtype: int64
- name: ddz_count
dtype: int64
- name: bpoc_count
dtype: int64
- name: nps_count
dtype: int64
- name: 9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: 2-(4-nitrophenylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: (1,1-dioxobenzo[b]thiophene-2-yl)methyloxycarbonyl_count
dtype: int64
- name: (1,1-dioxonaptho[1,2-b]thiophene-2-yl)methyloxycarbonyl_count
dtype: int64
- name: 1-(4,4-dimethyl-2,6-dioxocyclohex-1-ylidene)-3-methylbutyl_count
dtype: int64
- name: 2,7-di-tert-butyl-fmoc_count
dtype: int64
- name: 2-fluoro-fmoc_count
dtype: int64
- name: 2-monoisooctyl-fmoc_count
dtype: int64
- name: 2,7-diisooctyl-fmoc_count
dtype: int64
- name: tetrachlorophthaloyl_count
dtype: int64
- name: 2-[phenyl(methyl)sulfonio])ethyloxycarbonyltetrafluoroborate_count
dtype: int64
- name: ethanesulfonylethoxycarbonyl_count
dtype: int64
- name: 2-(4-sulfophenylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: fmoc_count
dtype: int64
- name: nsc_count
dtype: int64
- name: bsmoc_count
dtype: int64
- name: alpha-nsmoc_count
dtype: int64
- name: ivdde_count
dtype: int64
- name: fmoc*_count
dtype: int64
- name: fmoc(fmoc(2f))_count
dtype: int64
- name: mio-fmoc_count
dtype: int64
- name: dio-fmoc_count
dtype: int64
- name: tcp_count
dtype: int64
- name: pms_count
dtype: int64
- name: esc_count
dtype: int64
- name: sps_count
dtype: int64
- name: benzyloxycarbonyl_count
dtype: int64
- name: allyloxycarbonyl_count
dtype: int64
- name: o-nitrobenzenesulfonyl_count
dtype: int64
- name: 2,4-dinitrobenzenesulfonyl_count
dtype: int64
- name: benzothiazole-2-sulfonyl_count
dtype: int64
- name: 2,2,2-trichloroethyloxycarbonyl_count
dtype: int64
- name: dithiasuccinoyl_count
dtype: int64
- name: p-nitrobenzyloxycarbonyl_count
dtype: int64
- name: alpha-azidoacids_count
dtype: int64
- name: proparglyoxycarbonyl_count
dtype: int64
- name: o-nitrobenzylcarbonyl_count
dtype: int64
- name: 4-nitroveratryloxycarbonyl_count
dtype: int64
- name: 2-(2-nitrophenyl)propyloxycarbonyl_count
dtype: int64
- name: 2-(3,4-methylenedioxy-6-nitrophenyl)propyloxycarbonyl_count
dtype: int64
- name: 9-(4-bromophenyl)-9-fluorenyl_count
dtype: int64
- name: azidomethoxycarbonyl_count
dtype: int64
- name: hexafluoroacetone_count
dtype: int64
- name: Z_count
dtype: int64
- name: alloc_count
dtype: int64
- name: o-nbs_count
dtype: int64
- name: d-nbs_count
dtype: int64
- name: bts_count
dtype: int64
- name: troc_count
dtype: int64
- name: dts_count
dtype: int64
- name: pnz_count
dtype: int64
- name: poc_count
dtype: int64
- name: onz_count
dtype: int64
- name: nvoc_count
dtype: int64
- name: nppoc_count
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- name: mnppoc_count
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- name: brphf_count
dtype: int64
- name: azoc_count
dtype: int64
- name: hfa_count
dtype: int64
- name: 2-chlorobenzyloxycarbonyl_count
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- name: 4-methyltrityl_count
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- name: cl-z_count
dtype: int64
- name: mtt_count
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- name: 1-(4,4-dimethyl-2,6-dioxocylohex-1-ylidene)-3-methylbutyl_count
dtype: int64
- name: trifluoroacetyl_count
dtype: int64
- name: 2-(methylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: tfa_count
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- name: msc_count
dtype: int64
- name: phenyldisulphanylethyloxycarbonyl_count
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- name: 2-pyridyldisulphanylethyloxycarbonyl_count
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- name: phdec_count
dtype: int64
- name: pydec_count
dtype: int64
- name: tert-butyl_count
dtype: int64
- name: 2-chlorotrityl_count
dtype: int64
- name: 2-4-dimethyoxybenzyl_count
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- name: 2-phenylisopropyl_count
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- name: 5-phenyl-3,4-ethylenedioxythenyl_count
dtype: int64
- name: bu_count
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- name: 2-cl-trt_count
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- name: dmb_count
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- name: 2-ph-pr_count
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- name: phenyl-edotn_count
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- name: 9-fluorenylmethyl_count
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- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocylocheylidene)-3-methylbutyl]-amino)benzyl_count
dtype: int64
- name: methyl_count
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- name: ethyl_count
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- name: carbamoylmethyl_count
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- name: fm_count
dtype: int64
- name: dmab_count
dtype: int64
- name: me_count
dtype: int64
- name: et_count
dtype: int64
- name: cam_count
dtype: int64
- name: allyl_count
dtype: int64
- name: benzyl_count
dtype: int64
- name: phenacyl_count
dtype: int64
- name: p-nitrobenzyl_count
dtype: int64
- name: 2-trimethylsilyethyl_count
dtype: int64
- name: (2-phenyl-2-trimethylsilyl)ethyl_count
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- name: 2-(trimethylsilyl)isopropyl_count
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- name: 2,2,2-trichloroethyl_count
dtype: int64
- name: p-hydroxyphenacyl_count
dtype: int64
- name: 4,5-dimethyoxy-2-nitrobenzyl_count
dtype: int64
- name: 1,1-dimethylallyl_count
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- name: pentaaminecobalt_III_count
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- name: al_count
dtype: int64
- name: bn_count
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- name: pac_count
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- name: pnb_count
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- name: tmse_count
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- name: ptmse_count
dtype: int64
- name: tmsi_count
dtype: int64
- name: tce_count
dtype: int64
- name: php_count
dtype: int64
- name: dmnb_count
dtype: int64
- name: dma_count
dtype: int64
- name: cyclohexyl_count
dtype: int64
- name: b-menthyl_count
dtype: int64
- name: b-3-methylpent-3-yl_count
dtype: int64
- name: 4-(3,6,9-trioxadecyl)oxybenzyl_count
dtype: int64
- name: chx_count
dtype: int64
- name: men_count
dtype: int64
- name: mpe_count
dtype: int64
- name: tegbz_count
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- name: 9-fluoroenylmethyl_count
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- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-methyl-butyl]-amino)benzyl_count
dtype: int64
- name: trimethylsilylethyl_count
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- name: 4,5-dimethoxy-2-nitrobenzyloxycarbonyl_count
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- name: pseudoprolines_count
dtype: int64
- name: 2-hydroxy-4-methoxybenzyl_count
dtype: int64
- name: 2,4-dimethoxybenzyl_count
dtype: int64
- name: 2,4,6-trimethoxybenzyl_count
dtype: int64
- name: 1-methyl-3-indolylmethyl_count
dtype: int64
- name: 3,4-ethylene-dioxy-2-thenyl_count
dtype: int64
- name: hmb_count
dtype: int64
- name: tmob_count
dtype: int64
- name: mim_count
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- name: edot_count
dtype: int64
- name: 4-methoxy-2-nitro-benzyl_count
dtype: int64
- name: (6-hydroxy-3-oxido-1,3-benz[d]oxathiol-5-yl)methyl_count
dtype: int64
- name: 2-hydroxy-4-methoxy-5-(methylsulfinyl)benzyl_count
dtype: int64
- name: n-boc-n-methyl[2-(methylamino)ethyl]carbamoyl-hmb_count
dtype: int64
- name: 9-xanthenyl_count
dtype: int64
- name: cyclopropyldimethylcarbinyl_count
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- name: 4,4-dimethoxybenzhydryl_count
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- name: xan_count
dtype: int64
- name: cpd_count
dtype: int64
- name: mbh_count
dtype: int64
- name: p-toluenesulfonyl_count
dtype: int64
- name: 2,2,5,7,8-pentamethylchroman-6-sulfonyl_count
dtype: int64
- name: 2,2,4,6,7-pentamethyl-2,3-dihydrobenzofuran-5-sulfonyl_count
dtype: int64
- name: mesityl-2-sulfonyl_count
dtype: int64
- name: 4-methoxy-2,3,6-trimethylphenylsulfonyl_count
dtype: int64
- name: 1,2-dimethylindole-3-sulfonyl_count
dtype: int64
- name: w,w-bis-tert-butyloxycarbonyl_count
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- name: 5-dibenzosuberenyl_count
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- name: 5-dibenzosuberyl_count
dtype: int64
- name: 2-methoxy-5-dibenzosuberyl_count
dtype: int64
- name: nitro_count
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- name: tos_count
dtype: int64
- name: pmc_count
dtype: int64
- name: pbf_count
dtype: int64
- name: mts_count
dtype: int64
- name: mtr_count
dtype: int64
- name: mis_count
dtype: int64
- name: bis-boc_count
dtype: int64
- name: suben_count
dtype: int64
- name: sub_count
dtype: int64
- name: mesub_count
dtype: int64
- name: no2_count
dtype: int64
- name: w,w-bis-benzyloxycarbonyl_count
dtype: int64
- name: w,w-bis-allyloxycarbonyl_count
dtype: int64
- name: z-small_count
dtype: int64
- name: p-methylbenzyl_count
dtype: int64
- name: p-methoxybenzyl_count
dtype: int64
- name: monomethoxytrityl_count
dtype: int64
- name: trimethoxybenzyl_count
dtype: int64
- name: 2,2,4,6,7-pentamethyl-5-dihydrobenzofuranylmethyl_count
dtype: int64
- name: 1-adamantyl_count
dtype: int64
- name: meb_count
dtype: int64
- name: mob_count
dtype: int64
- name: mmt_count
dtype: int64
- name: pmbf_count
dtype: int64
- name: 1-ada_count
dtype: int64
- name: 2-(2,4-dinitrophenyl)ethyl_count
dtype: int64
- name: 9-fluororenylmethoxycarbonyl_count
dtype: int64
- name: dnpe_count
dtype: int64
- name: acetamidomethyl_count
dtype: int64
- name: phenylacetamidomethyl_count
dtype: int64
- name: 5-tert-butylmercapto_count
dtype: int64
- name: 3-nitro-2-pyridinesulfenyl_count
dtype: int64
- name: 2-pyridinesulfenyl_count
dtype: int64
- name: N-allyloxycarbonyl-N-[2,3,5,6-tetrafluoro-4-(phenylthio)phenyl]]aminomethyl_count
dtype: int64
- name: o-nitrobenzyl_count
dtype: int64
- name: 4-picolyl_count
dtype: int64
- name: ninhydrin_count
dtype: int64
- name: acm_count
dtype: int64
- name: phacm_count
dtype: int64
- name: sbu_count
dtype: int64
- name: npys_count
dtype: int64
- name: s-pyr_count
dtype: int64
- name: fsam_count
dtype: int64
- name: onb_count
dtype: int64
- name: nin_count
dtype: int64
- name: n-tosyl_count
dtype: int64
- name: n-trityl_count
dtype: int64
- name: n-monomethoxytrityl_count
dtype: int64
- name: n-methyltrityl_count
dtype: int64
- name: n-tert-butyloxycarbonyl_count
dtype: int64
- name: n-2,4-dimethylpent-3-yloxycarbonyl_count
dtype: int64
- name: n-benzyloxymethyl_count
dtype: int64
- name: n-tert-butoxymethyl_count
dtype: int64
- name: ntos_count
dtype: int64
- name: ntrt_count
dtype: int64
- name: nmtt_count
dtype: int64
- name: nmmt_count
dtype: int64
- name: nboc_count
dtype: int64
- name: ndoc_count
dtype: int64
- name: nbom_count
dtype: int64
- name: nbum_count
dtype: int64
- name: N-9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: N-2,6-dimethoxybenzoyl_count
dtype: int64
- name: dmbz_count
dtype: int64
- name: N-2,4-dinitrophenyl_count
dtype: int64
- name: dnp_count
dtype: int64
- name: cyclohexyl;_count
dtype: int64
- name: tert-butyldimethylsilyl_count
dtype: int64
- name: tbdms_count
dtype: int64
- name: tert-butyldiphenylsilyl_count
dtype: int64
- name: propargyloxycarbonyl_count
dtype: int64
- name: tbdps_count
dtype: int64
- name: 2,6-dichlorobenzyl_count
dtype: int64
- name: 2-bromobenzyl_count
dtype: int64
- name: 2-bromobenzyloxycarbonyl_count
dtype: int64
- name: 3-pentyl_count
dtype: int64
- name: dcb_count
dtype: int64
- name: brbn_count
dtype: int64
- name: brz_count
dtype: int64
- name: pen_count
dtype: int64
- name: tegb_count
dtype: int64
- name: boc-n-methyl-n-[2-(methylamino)ethyl]carbamoyl_count
dtype: int64
- name: boc-nmec_count
dtype: int64
- name: formyl_count
dtype: int64
- name: cyclohexyloxycarbonyl_count
dtype: int64
- name: for_count
dtype: int64
- name: hoc_count
dtype: int64
- name: cyclopropane_count
dtype: int64
- name: spiropentane_count
dtype: int64
- name: cyclobutane_count
dtype: int64
- name: cyclopentane_count
dtype: int64
- name: furan_count
dtype: int64
- name: thiophene_count
dtype: int64
- name: pyrrole_count
dtype: int64
- name: 2H-pyrrole_count
dtype: int64
- name: 3H-pyrrole_count
dtype: int64
- name: pyrazole_count
dtype: int64
- name: 2H-imidazole_count
dtype: int64
- name: 1,2,3-triazole_count
dtype: int64
- name: 1,2,4-triazole_count
dtype: int64
- name: 1,2-dithiole_count
dtype: int64
- name: 1,3-dithiole_count
dtype: int64
- name: 3H-1,2-oxathiole_count
dtype: int64
- name: isoxazole_count
dtype: int64
- name: oxazole_count
dtype: int64
- name: thiazole_count
dtype: int64
- name: isothiazole_count
dtype: int64
- name: 1,2,3-oxadiazole_count
dtype: int64
- name: 1,2,4-oxadiazole_count
dtype: int64
- name: 1,2,5-oxadiazole_count
dtype: int64
- name: 1,3,4-oxadiazole_count
dtype: int64
- name: 1,2,3,4-oxatriazole_count
dtype: int64
- name: 1,2,3,5-oxatriazole_count
dtype: int64
- name: 3H-1,2,3-dioxazole_count
dtype: int64
- name: 1,2,4-dioxazole_count
dtype: int64
- name: 1,3,2-dioxazole_count
dtype: int64
- name: 1,3,4-dioxazole_count
dtype: int64
- name: 5H-1,2,5-oxathiazole_count
dtype: int64
- name: 1,3-oxathiole_count
dtype: int64
- name: benzene_count
dtype: int64
- name: cyclohexane_count
dtype: int64
- name: 2H-pyran_count
dtype: int64
- name: 4H-pyran_count
dtype: int64
- name: 2H-pyran-2-one_count
dtype: int64
- name: 4H-pyran-4-one_count
dtype: int64
- name: 1,2-dioxin_count
dtype: int64
- name: 1,3-dioxin_count
dtype: int64
- name: pyridine_count
dtype: int64
- name: pyridazine_count
dtype: int64
- name: pyrimidine_count
dtype: int64
- name: pyrazine_count
dtype: int64
- name: piperazine_count
dtype: int64
- name: 1,3,5-triazine_count
dtype: int64
- name: 1,2,4-triazine_count
dtype: int64
- name: 1,2,3-triazine_count
dtype: int64
- name: 4H-1,2-Oxazine_count
dtype: int64
- name: 2H-1,3-Oxazine_count
dtype: int64
- name: 6H-1,3-Oxazine_count
dtype: int64
- name: 6H-1,2-Oxazine_count
dtype: int64
- name: 1,4-Oxazine_count
dtype: int64
- name: 2H-1,2-Oxazine_count
dtype: int64
- name: 4H-1,4-Oxazine_count
dtype: int64
- name: 1,2,5-Oxathiazine_count
dtype: int64
- name: 1,2,6-Oxathiazine_count
dtype: int64
- name: 1,2,4-Oxadiazine_count
dtype: int64
- name: 1,3,5-Oxadiazine_count
dtype: int64
- name: morpholine_count
dtype: int64
- name: azepine_count
dtype: int64
- name: oxepin_count
dtype: int64
- name: thiepin_count
dtype: int64
- name: 4H-1,2-diazepine_count
dtype: int64
- name: indene_count
dtype: int64
- name: 2H-indene_count
dtype: int64
- name: benzofuran_count
dtype: int64
- name: isobenzofuran_count
dtype: int64
- name: benzo[b]thiophene_count
dtype: int64
- name: benzo[c]thiophene_count
dtype: int64
- name: indole_count
dtype: int64
- name: 3H-indole_count
dtype: int64
- name: 1H-indole_count
dtype: int64
- name: cyclopenta[b]pyridine_count
dtype: int64
- name: pyrano[3,4-b]-pyrrole_count
dtype: int64
- name: indazole_count
dtype: int64
- name: benzisoxazole_count
dtype: int64
- name: benzoxazole_count
dtype: int64
- name: 2,1-benzisoxazole_count
dtype: int64
- name: naphthalene_count
dtype: int64
- name: 1,2,3,4-tetrahydronaphthalene_count
dtype: int64
- name: octahydronaphthalene_count
dtype: int64
- name: 2H-1-benzopyran_count
dtype: int64
- name: 2H-1-benzopyran-2-one_count
dtype: int64
- name: 4H-1-benzopyran-4-one_count
dtype: int64
- name: 1H-2-benzopyran-1-one_count
dtype: int64
- name: 3H-2-benzopyran-1-one_count
dtype: int64
- name: quinoline_count
dtype: int64
- name: isoquinoline_count
dtype: int64
- name: cinnoline_count
dtype: int64
- name: quinazoline_count
dtype: int64
- name: 1,8-napthyhridine_count
dtype: int64
- name: 1,7-napththyridine_count
dtype: int64
- name: 1,5-napththridine_count
dtype: int64
- name: 1,6-napthyridine_count
dtype: int64
- name: 2H-1,3-benzoxazine_count
dtype: int64
- name: 2H-1,4-benzoxazine_count
dtype: int64
- name: 1H-2,3-benzoxazine_count
dtype: int64
- name: 4H-3,1-benzoxazine_count
dtype: int64
- name: 2H-1,2-benzoxazine_count
dtype: int64
- name: 4H-1,3-benzoxazine_count
dtype: int64
- name: anthracene_count
dtype: int64
- name: phenanthrene_count
dtype: int64
- name: phenalene_count
dtype: int64
- name: fluorene_count
dtype: int64
- name: carbazole_count
dtype: int64
- name: xanthene_count
dtype: int64
- name: acridine_count
dtype: int64
- name: norpinane_count
dtype: int64
- name: 7H-purine_count
dtype: int64
- name: steroid_ring_system_count
dtype: int64
- name: imidazole_count
dtype: int64
- name: thiazol-2-amine_count
dtype: int64
- name: tetrazole_count
dtype: int64
- name: cytosine_count
dtype: int64
- name: adenine_count
dtype: int64
- name: 5-methylindole_count
dtype: int64
- name: isocaffeine_count
dtype: int64
- name: tetrazolethiol_count
dtype: int64
- name: 3-methylisoxazole_count
dtype: int64
- name: 1-methylimidazole_count
dtype: int64
- name: 2-methylimidazole_count
dtype: int64
- name: guanine_count
dtype: int64
- name: tosufloxacin_count
dtype: int64
- name: acetamido_count
dtype: int64
- name: acetoacetyl_count
dtype: int64
- name: acetyl_count
dtype: int64
- name: acryloyl_count
dtype: int64
- name: alanyl_count
dtype: int64
- name: beta-alanyl_count
dtype: int64
- name: allylidene_count
dtype: int64
- name: amidino_count
dtype: int64
- name: amino_count
dtype: int64
- name: amyl_count
dtype: int64
- name: anilino_count
dtype: int64
- name: anisidino_count
dtype: int64
- name: anthranoyl_count
dtype: int64
- name: arsino_count
dtype: int64
- name: azelaoyl_count
dtype: int64
- name: azido_count
dtype: int64
- name: azo_count
dtype: int64
- name: azoxy_count
dtype: int64
- name: benzal_count
dtype: int64
- name: benzamido_count
dtype: int64
- name: benzhydrol_count
dtype: int64
- name: benzoxy_count
dtype: int64
- name: benzoyl_count
dtype: int64
- name: benzylidene_count
dtype: int64
- name: benzylidyne_count
dtype: int64
- name: biphenylyl_count
dtype: int64
- name: biphenylene_count
dtype: int64
- name: butoxy_count
dtype: int64
- name: sec-butoxy_count
dtype: int64
- name: tert-butoxy_count
dtype: int64
- name: butyl_count
dtype: int64
- name: sec-butyl_count
dtype: int64
- name: butyryl_count
dtype: int64
- name: caproyl_count
dtype: int64
- name: capryl_count
dtype: int64
- name: capryloyl_count
dtype: int64
- name: carbamido_count
dtype: int64
- name: carbamoyl_count
dtype: int64
- name: carbamyl_count
dtype: int64
- name: carbazoyl_count
dtype: int64
- name: carbethoxy_count
dtype: int64
- name: carbonyl_count
dtype: int64
- name: carboxy_count
dtype: int64
- name: cetyl_count
dtype: int64
- name: chloroformyl_count
dtype: int64
- name: cinnamoyl_count
dtype: int64
- name: cinnamyl_count
dtype: int64
- name: cinnamylidene_count
dtype: int64
- name: cresyl_count
dtype: int64
- name: crotonoyl_count
dtype: int64
- name: crotyl_count
dtype: int64
- name: cyanamido_count
dtype: int64
- name: cyanato_count
dtype: int64
- name: cyano_count
dtype: int64
- name: decanedioyl_count
dtype: int64
- name: decanoyl_count
dtype: int64
- name: diazo_count
dtype: int64
- name: diazoamino_count
dtype: int64
- name: disilanyl_count
dtype: int64
- name: disiloxanyloxy_count
dtype: int64
- name: disulfinyl_count
dtype: int64
- name: dithio_count
dtype: int64
- name: enanthoyl_count
dtype: int64
- name: epoxy_count
dtype: int64
- name: ethenyl_count
dtype: int64
- name: ethynyl_count
dtype: int64
- name: ethoxy_count
dtype: int64
- name: ethylene_count
dtype: int64
- name: ethylidene_count
dtype: int64
- name: ethylthio_count
dtype: int64
- name: formamido_count
dtype: int64
- name: furmaroyl_count
dtype: int64
- name: furfuryl_count
dtype: int64
- name: furfurylidene_count
dtype: int64
- name: glutamoyl_count
dtype: int64
- name: glutaryl_count
dtype: int64
- name: glycylamino_count
dtype: int64
- name: glycoloyl_count
dtype: int64
- name: glycyl_count
dtype: int64
- name: glyoxyoyl_count
dtype: int64
- name: guanidino_count
dtype: int64
- name: guanyl_count
dtype: int64
- name: heptadecanoyl_count
dtype: int64
- name: heptanamido_count
dtype: int64
- name: heptanoyl_count
dtype: int64
- name: hexadecanoyl_count
dtype: int64
- name: hexamethylene_count
dtype: int64
- name: hexanedioyl_count
dtype: int64
- name: hippuryl_count
dtype: int64
- name: hydrazino_count
dtype: int64
- name: hydrazo_count
dtype: int64
- name: hydrocinnamoyl_count
dtype: int64
- name: hydroperoxy_count
dtype: int64
- name: hydroxyamino_count
dtype: int64
- name: imino_count
dtype: int64
- name: iodoso_count
dtype: int64
- name: iodyl_count
dtype: int64
- name: isoamyl_count
dtype: int64
- name: isobutenyl_count
dtype: int64
- name: isobutoxy_count
dtype: int64
- name: isobutyl_count
dtype: int64
- name: isobutylidene_count
dtype: int64
- name: isobutyryl_count
dtype: int64
- name: isocyanato_count
dtype: int64
- name: isocyano_count
dtype: int64
- name: isohexyl_count
dtype: int64
- name: isoleucyl_count
dtype: int64
- name: isonitroso_count
dtype: int64
- name: isopentyl_count
dtype: int64
- name: isopentylidene_count
dtype: int64
- name: isopropenyl_count
dtype: int64
- name: isopropoxy_count
dtype: int64
- name: isopropyl_count
dtype: int64
- name: isopropylidene_count
dtype: int64
- name: isothiocynato_count
dtype: int64
- name: isovaleryl_count
dtype: int64
- name: lactoyl_count
dtype: int64
- name: lauroyl_count
dtype: int64
- name: lauryl_count
dtype: int64
- name: leucyl_count
dtype: int64
- name: levulinoyl_count
dtype: int64
- name: malonyl_count
dtype: int64
- name: mandeloyl_count
dtype: int64
- name: mercapto_count
dtype: int64
- name: mesityl_count
dtype: int64
- name: methacryloyl_count
dtype: int64
- name: methallyl_count
dtype: int64
- name: methionyl_count
dtype: int64
- name: methoxy_count
dtype: int64
- name: methylene_count
dtype: int64
- name: methylthio_count
dtype: int64
- name: myristoyl_count
dtype: int64
- name: myristyl_count
dtype: int64
- name: naphthyl_count
dtype: int64
- name: naphthylene_count
dtype: int64
- name: neopentyl_count
dtype: int64
- name: nitramino_count
dtype: int64
- name: nitrosamino_count
dtype: int64
- name: nitroso_count
dtype: int64
- name: nonanoyl_count
dtype: int64
- name: oleoyl_count
dtype: int64
- name: oxalyl_count
dtype: int64
- name: oxo_count
dtype: int64
- name: palmitoyl_count
dtype: int64
- name: pentamethylene_count
dtype: int64
- name: pentyl_count
dtype: int64
- name: tert-pentyl_count
dtype: int64
- name: phenacylidene_count
dtype: int64
- name: phenethyl_count
dtype: int64
- name: phenoxy_count
dtype: int64
- name: phenyl_count
dtype: int64
- name: phenylene_count
dtype: int64
- name: phosphino_count
dtype: int64
- name: phosphinyl_count
dtype: int64
- name: phospho_count
dtype: int64
- name: phosphono_count
dtype: int64
- name: phthaloyl_count
dtype: int64
- name: picryl_count
dtype: int64
- name: pimeloyl_count
dtype: int64
- name: piperidino_count
dtype: int64
- name: pivaloyl_count
dtype: int64
- name: prenyl_count
dtype: int64
- name: propargyl_count
dtype: int64
- name: 1-propenyl_count
dtype: int64
- name: 2-propenyl_count
dtype: int64
- name: propionyl_count
dtype: int64
- name: propoxy_count
dtype: int64
- name: propyl_count
dtype: int64
- name: propylidene_count
dtype: int64
- name: pyrryl_count
dtype: int64
- name: salicyloyl_count
dtype: int64
- name: selenyl_count
dtype: int64
- name: seryl_count
dtype: int64
- name: siloxy_count
dtype: int64
- name: silyl_count
dtype: int64
- name: silyene_count
dtype: int64
- name: sorboyl_count
dtype: int64
- name: stearoyl_count
dtype: int64
- name: stearyl_count
dtype: int64
- name: styryl_count
dtype: int64
- name: suberoyl_count
dtype: int64
- name: succinyl_count
dtype: int64
- name: sulfamino_count
dtype: int64
- name: sulfamoyl_count
dtype: int64
- name: sulfanilyl_count
dtype: int64
- name: sulfeno_count
dtype: int64
- name: sulfhydryl_count
dtype: int64
- name: sulfinyl_count
dtype: int64
- name: sulfo_count
dtype: int64
- name: sulfonyl_count
dtype: int64
- name: terephthaloyl_count
dtype: int64
- name: tetramethylene_count
dtype: int64
- name: thienyl_count
dtype: int64
- name: thiocarbonyl_count
dtype: int64
- name: thiocarboxy_count
dtype: int64
- name: thiocyanato_count
dtype: int64
- name: thionyl_count
dtype: int64
- name: threonyl_count
dtype: int64
- name: toluidino_count
dtype: int64
- name: toluoyl_count
dtype: int64
- name: tolyl_count
dtype: int64
- name: alpha-tolyl_count
dtype: int64
- name: tolylene_count
dtype: int64
- name: tosyl_count
dtype: int64
- name: triazano_count
dtype: int64
- name: trimethylene_count
dtype: int64
- name: valeryl_count
dtype: int64
- name: valyl_count
dtype: int64
- name: vinyl_count
dtype: int64
- name: vinylidene_count
dtype: int64
- name: xylidino_count
dtype: int64
- name: xylyl_count
dtype: int64
- name: xylylene_count
dtype: int64
- name: propiolamide_count
dtype: int64
- name: fumarate ester_count
dtype: int64
- name: allenamide_count
dtype: int64
- name: propiolonitrile_count
dtype: int64
- name: propargylamide_count
dtype: int64
- name: arylsulfonyl bicyclobutane_count
dtype: int64
- name: haloalkane_count
dtype: int64
- name: alpha-halomethyl_count
dtype: int64
- name: alpha-haloamide_count
dtype: int64
- name: alpha-haloester_count
dtype: int64
- name: epoxide_count
dtype: int64
- name: aziridine_count
dtype: int64
- name: nitroalkane_count
dtype: int64
- name: acrylamide_count
dtype: int64
- name: cyanoenone_count
dtype: int64
- name: aldehyde_count
dtype: int64
- name: ketone_count
dtype: int64
- name: nitrile_count
dtype: int64
- name: cyanamide_count
dtype: int64
- name: isothicyanate_count
dtype: int64
- name: sulfone_count
dtype: int64
- name: sulfonyl fluoride_count
dtype: int64
- name: sulfonimidoyl fluoride_count
dtype: int64
- name: aryl fluorosulfate_count
dtype: int64
- name: ester_count
dtype: int64
- name: sulfonamide_count
dtype: int64
- name: 2-carbonyl arylboronic acid_count
dtype: int64
- name: n-methyl isoxazolium_count
dtype: int64
- name: oxaziridine_count
dtype: int64
- name: carboxyl_count
dtype: int64
- name: ether_count
dtype: int64
- name: alkanol_count
dtype: int64
- name: thiol_count
dtype: int64
- name: halogen_count
dtype: int64
- name: amine_count
dtype: int64
- name: amide_count
dtype: int64
- name: num_valence_electrons
dtype: int64
- name: rotable_proportion
dtype: float64
- name: non_rotable_proportion
dtype: float64
- name: num_unspecified_bond
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- name: num_single_bonds
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- name: num_double_bonds
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- name: num_triple_bonds
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- name: num_quadruple_bonds
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- name: num_quintuple_bonds
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- name: num_hextuple_bonds
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- name: num_oneandahalf_bonds
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- name: num_twoandahalf_bonds
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- name: num_threeandahalf_bonds
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- name: num_fourandahalf_bonds
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- name: num_fiveandahalf_bonds
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- name: num_aromatic_bonds
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- name: num_ionic_bonds
dtype: float64
- name: num_hydrogen_bonds
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- name: num_threecenter_bonds
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- name: num_dativeone_bonds
dtype: float64
- name: num_dative_bonds
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- name: num_other_bonds
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- name: num_zero_bonds
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- name: num_bonds
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- name: molecular_formula
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- name: carbon_mass
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- name: hydrogen_mass
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- name: nitrogen_mass
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- name: oxygen_mass
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- name: num_carbon_atoms
dtype: int64
- name: num_hydrogen_atoms
dtype: int64
- name: num_nitrogen_atoms
dtype: int64
- name: num_oxygen_atoms
dtype: int64
- name: num_hydrogen_bond_acceptors
dtype: int64
- name: num_hydrogen_bond_donors
dtype: int64
- name: num_lipinski_violations
dtype: int64
- name: inertial_shape_factor
dtype: float64
- name: eccentricity
dtype: float64
- name: asphericity
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- name: npr1_value
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- name: npr2_value
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- name: pmi1_value
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- name: pmi2_value
dtype: float64
- name: pmi3_value
dtype: float64
- name: num_chiral_centers
dtype: int64
- name: representation
dtype: string
splits:
- name: train
num_bytes: 2756085
num_examples: 500
download_size: 497203
dataset_size: 2756085
- config_name: rdkit_feat_3
features:
- name: tert-butyloxycarbonyl_count
dtype: int64
- name: representation_type
dtype: string
- name: trityl_count
dtype: int64
- name: 3,5-dimethoxyphenylisoproxycarbonyl_count
dtype: int64
- name: 2-(4-biphenyl)isopropoxycarbonyl_count
dtype: int64
- name: 2-nitrophenylsulfenyl_count
dtype: int64
- name: boc_count
dtype: int64
- name: trt_count
dtype: int64
- name: ddz_count
dtype: int64
- name: bpoc_count
dtype: int64
- name: nps_count
dtype: int64
- name: 9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: 2-(4-nitrophenylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: (1,1-dioxobenzo[b]thiophene-2-yl)methyloxycarbonyl_count
dtype: int64
- name: (1,1-dioxonaptho[1,2-b]thiophene-2-yl)methyloxycarbonyl_count
dtype: int64
- name: 1-(4,4-dimethyl-2,6-dioxocyclohex-1-ylidene)-3-methylbutyl_count
dtype: int64
- name: 2,7-di-tert-butyl-fmoc_count
dtype: int64
- name: 2-fluoro-fmoc_count
dtype: int64
- name: 2-monoisooctyl-fmoc_count
dtype: int64
- name: 2,7-diisooctyl-fmoc_count
dtype: int64
- name: tetrachlorophthaloyl_count
dtype: int64
- name: 2-[phenyl(methyl)sulfonio])ethyloxycarbonyltetrafluoroborate_count
dtype: int64
- name: ethanesulfonylethoxycarbonyl_count
dtype: int64
- name: 2-(4-sulfophenylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: fmoc_count
dtype: int64
- name: nsc_count
dtype: int64
- name: bsmoc_count
dtype: int64
- name: alpha-nsmoc_count
dtype: int64
- name: ivdde_count
dtype: int64
- name: fmoc*_count
dtype: int64
- name: fmoc(fmoc(2f))_count
dtype: int64
- name: mio-fmoc_count
dtype: int64
- name: dio-fmoc_count
dtype: int64
- name: tcp_count
dtype: int64
- name: pms_count
dtype: int64
- name: esc_count
dtype: int64
- name: sps_count
dtype: int64
- name: benzyloxycarbonyl_count
dtype: int64
- name: allyloxycarbonyl_count
dtype: int64
- name: o-nitrobenzenesulfonyl_count
dtype: int64
- name: 2,4-dinitrobenzenesulfonyl_count
dtype: int64
- name: benzothiazole-2-sulfonyl_count
dtype: int64
- name: 2,2,2-trichloroethyloxycarbonyl_count
dtype: int64
- name: dithiasuccinoyl_count
dtype: int64
- name: p-nitrobenzyloxycarbonyl_count
dtype: int64
- name: alpha-azidoacids_count
dtype: int64
- name: proparglyoxycarbonyl_count
dtype: int64
- name: o-nitrobenzylcarbonyl_count
dtype: int64
- name: 4-nitroveratryloxycarbonyl_count
dtype: int64
- name: 2-(2-nitrophenyl)propyloxycarbonyl_count
dtype: int64
- name: 2-(3,4-methylenedioxy-6-nitrophenyl)propyloxycarbonyl_count
dtype: int64
- name: 9-(4-bromophenyl)-9-fluorenyl_count
dtype: int64
- name: azidomethoxycarbonyl_count
dtype: int64
- name: hexafluoroacetone_count
dtype: int64
- name: Z_count
dtype: int64
- name: alloc_count
dtype: int64
- name: o-nbs_count
dtype: int64
- name: d-nbs_count
dtype: int64
- name: bts_count
dtype: int64
- name: troc_count
dtype: int64
- name: dts_count
dtype: int64
- name: pnz_count
dtype: int64
- name: poc_count
dtype: int64
- name: onz_count
dtype: int64
- name: nvoc_count
dtype: int64
- name: nppoc_count
dtype: int64
- name: mnppoc_count
dtype: int64
- name: brphf_count
dtype: int64
- name: azoc_count
dtype: int64
- name: hfa_count
dtype: int64
- name: 2-chlorobenzyloxycarbonyl_count
dtype: int64
- name: 4-methyltrityl_count
dtype: int64
- name: cl-z_count
dtype: int64
- name: mtt_count
dtype: int64
- name: 1-(4,4-dimethyl-2,6-dioxocylohex-1-ylidene)-3-methylbutyl_count
dtype: int64
- name: trifluoroacetyl_count
dtype: int64
- name: 2-(methylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: tfa_count
dtype: int64
- name: msc_count
dtype: int64
- name: phenyldisulphanylethyloxycarbonyl_count
dtype: int64
- name: 2-pyridyldisulphanylethyloxycarbonyl_count
dtype: int64
- name: phdec_count
dtype: int64
- name: pydec_count
dtype: int64
- name: tert-butyl_count
dtype: int64
- name: 2-chlorotrityl_count
dtype: int64
- name: 2-4-dimethyoxybenzyl_count
dtype: int64
- name: 2-phenylisopropyl_count
dtype: int64
- name: 5-phenyl-3,4-ethylenedioxythenyl_count
dtype: int64
- name: bu_count
dtype: int64
- name: 2-cl-trt_count
dtype: int64
- name: dmb_count
dtype: int64
- name: 2-ph-pr_count
dtype: int64
- name: phenyl-edotn_count
dtype: int64
- name: 9-fluorenylmethyl_count
dtype: int64
- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocylocheylidene)-3-methylbutyl]-amino)benzyl_count
dtype: int64
- name: methyl_count
dtype: int64
- name: ethyl_count
dtype: int64
- name: carbamoylmethyl_count
dtype: int64
- name: fm_count
dtype: int64
- name: dmab_count
dtype: int64
- name: me_count
dtype: int64
- name: et_count
dtype: int64
- name: cam_count
dtype: int64
- name: allyl_count
dtype: int64
- name: benzyl_count
dtype: int64
- name: phenacyl_count
dtype: int64
- name: p-nitrobenzyl_count
dtype: int64
- name: 2-trimethylsilyethyl_count
dtype: int64
- name: (2-phenyl-2-trimethylsilyl)ethyl_count
dtype: int64
- name: 2-(trimethylsilyl)isopropyl_count
dtype: int64
- name: 2,2,2-trichloroethyl_count
dtype: int64
- name: p-hydroxyphenacyl_count
dtype: int64
- name: 4,5-dimethyoxy-2-nitrobenzyl_count
dtype: int64
- name: 1,1-dimethylallyl_count
dtype: int64
- name: pentaaminecobalt_III_count
dtype: int64
- name: al_count
dtype: int64
- name: bn_count
dtype: int64
- name: pac_count
dtype: int64
- name: pnb_count
dtype: int64
- name: tmse_count
dtype: int64
- name: ptmse_count
dtype: int64
- name: tmsi_count
dtype: int64
- name: tce_count
dtype: int64
- name: php_count
dtype: int64
- name: dmnb_count
dtype: int64
- name: dma_count
dtype: int64
- name: cyclohexyl_count
dtype: int64
- name: b-menthyl_count
dtype: int64
- name: b-3-methylpent-3-yl_count
dtype: int64
- name: 4-(3,6,9-trioxadecyl)oxybenzyl_count
dtype: int64
- name: chx_count
dtype: int64
- name: men_count
dtype: int64
- name: mpe_count
dtype: int64
- name: tegbz_count
dtype: int64
- name: 9-fluoroenylmethyl_count
dtype: int64
- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-methyl-butyl]-amino)benzyl_count
dtype: int64
- name: trimethylsilylethyl_count
dtype: int64
- name: 4,5-dimethoxy-2-nitrobenzyloxycarbonyl_count
dtype: int64
- name: pseudoprolines_count
dtype: int64
- name: 2-hydroxy-4-methoxybenzyl_count
dtype: int64
- name: 2,4-dimethoxybenzyl_count
dtype: int64
- name: 2,4,6-trimethoxybenzyl_count
dtype: int64
- name: 1-methyl-3-indolylmethyl_count
dtype: int64
- name: 3,4-ethylene-dioxy-2-thenyl_count
dtype: int64
- name: hmb_count
dtype: int64
- name: tmob_count
dtype: int64
- name: mim_count
dtype: int64
- name: edot_count
dtype: int64
- name: 4-methoxy-2-nitro-benzyl_count
dtype: int64
- name: (6-hydroxy-3-oxido-1,3-benz[d]oxathiol-5-yl)methyl_count
dtype: int64
- name: 2-hydroxy-4-methoxy-5-(methylsulfinyl)benzyl_count
dtype: int64
- name: n-boc-n-methyl[2-(methylamino)ethyl]carbamoyl-hmb_count
dtype: int64
- name: 9-xanthenyl_count
dtype: int64
- name: cyclopropyldimethylcarbinyl_count
dtype: int64
- name: 4,4-dimethoxybenzhydryl_count
dtype: int64
- name: xan_count
dtype: int64
- name: cpd_count
dtype: int64
- name: mbh_count
dtype: int64
- name: p-toluenesulfonyl_count
dtype: int64
- name: 2,2,5,7,8-pentamethylchroman-6-sulfonyl_count
dtype: int64
- name: 2,2,4,6,7-pentamethyl-2,3-dihydrobenzofuran-5-sulfonyl_count
dtype: int64
- name: mesityl-2-sulfonyl_count
dtype: int64
- name: 4-methoxy-2,3,6-trimethylphenylsulfonyl_count
dtype: int64
- name: 1,2-dimethylindole-3-sulfonyl_count
dtype: int64
- name: w,w-bis-tert-butyloxycarbonyl_count
dtype: int64
- name: 5-dibenzosuberenyl_count
dtype: int64
- name: 5-dibenzosuberyl_count
dtype: int64
- name: 2-methoxy-5-dibenzosuberyl_count
dtype: int64
- name: nitro_count
dtype: int64
- name: tos_count
dtype: int64
- name: pmc_count
dtype: int64
- name: pbf_count
dtype: int64
- name: mts_count
dtype: int64
- name: mtr_count
dtype: int64
- name: mis_count
dtype: int64
- name: bis-boc_count
dtype: int64
- name: suben_count
dtype: int64
- name: sub_count
dtype: int64
- name: mesub_count
dtype: int64
- name: no2_count
dtype: int64
- name: w,w-bis-benzyloxycarbonyl_count
dtype: int64
- name: w,w-bis-allyloxycarbonyl_count
dtype: int64
- name: z-small_count
dtype: int64
- name: p-methylbenzyl_count
dtype: int64
- name: p-methoxybenzyl_count
dtype: int64
- name: monomethoxytrityl_count
dtype: int64
- name: trimethoxybenzyl_count
dtype: int64
- name: 2,2,4,6,7-pentamethyl-5-dihydrobenzofuranylmethyl_count
dtype: int64
- name: 1-adamantyl_count
dtype: int64
- name: meb_count
dtype: int64
- name: mob_count
dtype: int64
- name: mmt_count
dtype: int64
- name: pmbf_count
dtype: int64
- name: 1-ada_count
dtype: int64
- name: 2-(2,4-dinitrophenyl)ethyl_count
dtype: int64
- name: 9-fluororenylmethoxycarbonyl_count
dtype: int64
- name: dnpe_count
dtype: int64
- name: acetamidomethyl_count
dtype: int64
- name: phenylacetamidomethyl_count
dtype: int64
- name: 5-tert-butylmercapto_count
dtype: int64
- name: 3-nitro-2-pyridinesulfenyl_count
dtype: int64
- name: 2-pyridinesulfenyl_count
dtype: int64
- name: N-allyloxycarbonyl-N-[2,3,5,6-tetrafluoro-4-(phenylthio)phenyl]]aminomethyl_count
dtype: int64
- name: o-nitrobenzyl_count
dtype: int64
- name: 4-picolyl_count
dtype: int64
- name: ninhydrin_count
dtype: int64
- name: acm_count
dtype: int64
- name: phacm_count
dtype: int64
- name: sbu_count
dtype: int64
- name: npys_count
dtype: int64
- name: s-pyr_count
dtype: int64
- name: fsam_count
dtype: int64
- name: onb_count
dtype: int64
- name: nin_count
dtype: int64
- name: n-tosyl_count
dtype: int64
- name: n-trityl_count
dtype: int64
- name: n-monomethoxytrityl_count
dtype: int64
- name: n-methyltrityl_count
dtype: int64
- name: n-tert-butyloxycarbonyl_count
dtype: int64
- name: n-2,4-dimethylpent-3-yloxycarbonyl_count
dtype: int64
- name: n-benzyloxymethyl_count
dtype: int64
- name: n-tert-butoxymethyl_count
dtype: int64
- name: ntos_count
dtype: int64
- name: ntrt_count
dtype: int64
- name: nmtt_count
dtype: int64
- name: nmmt_count
dtype: int64
- name: nboc_count
dtype: int64
- name: ndoc_count
dtype: int64
- name: nbom_count
dtype: int64
- name: nbum_count
dtype: int64
- name: N-9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: N-2,6-dimethoxybenzoyl_count
dtype: int64
- name: dmbz_count
dtype: int64
- name: N-2,4-dinitrophenyl_count
dtype: int64
- name: dnp_count
dtype: int64
- name: cyclohexyl;_count
dtype: int64
- name: tert-butyldimethylsilyl_count
dtype: int64
- name: tbdms_count
dtype: int64
- name: tert-butyldiphenylsilyl_count
dtype: int64
- name: propargyloxycarbonyl_count
dtype: int64
- name: tbdps_count
dtype: int64
- name: 2,6-dichlorobenzyl_count
dtype: int64
- name: 2-bromobenzyl_count
dtype: int64
- name: 2-bromobenzyloxycarbonyl_count
dtype: int64
- name: 3-pentyl_count
dtype: int64
- name: dcb_count
dtype: int64
- name: brbn_count
dtype: int64
- name: brz_count
dtype: int64
- name: pen_count
dtype: int64
- name: tegb_count
dtype: int64
- name: boc-n-methyl-n-[2-(methylamino)ethyl]carbamoyl_count
dtype: int64
- name: boc-nmec_count
dtype: int64
- name: formyl_count
dtype: int64
- name: cyclohexyloxycarbonyl_count
dtype: int64
- name: for_count
dtype: int64
- name: hoc_count
dtype: int64
- name: cyclopropane_count
dtype: int64
- name: spiropentane_count
dtype: int64
- name: cyclobutane_count
dtype: int64
- name: cyclopentane_count
dtype: int64
- name: furan_count
dtype: int64
- name: thiophene_count
dtype: int64
- name: pyrrole_count
dtype: int64
- name: 2H-pyrrole_count
dtype: int64
- name: 3H-pyrrole_count
dtype: int64
- name: pyrazole_count
dtype: int64
- name: 2H-imidazole_count
dtype: int64
- name: 1,2,3-triazole_count
dtype: int64
- name: 1,2,4-triazole_count
dtype: int64
- name: 1,2-dithiole_count
dtype: int64
- name: 1,3-dithiole_count
dtype: int64
- name: 3H-1,2-oxathiole_count
dtype: int64
- name: isoxazole_count
dtype: int64
- name: oxazole_count
dtype: int64
- name: thiazole_count
dtype: int64
- name: isothiazole_count
dtype: int64
- name: 1,2,3-oxadiazole_count
dtype: int64
- name: 1,2,4-oxadiazole_count
dtype: int64
- name: 1,2,5-oxadiazole_count
dtype: int64
- name: 1,3,4-oxadiazole_count
dtype: int64
- name: 1,2,3,4-oxatriazole_count
dtype: int64
- name: 1,2,3,5-oxatriazole_count
dtype: int64
- name: 3H-1,2,3-dioxazole_count
dtype: int64
- name: 1,2,4-dioxazole_count
dtype: int64
- name: 1,3,2-dioxazole_count
dtype: int64
- name: 1,3,4-dioxazole_count
dtype: int64
- name: 5H-1,2,5-oxathiazole_count
dtype: int64
- name: 1,3-oxathiole_count
dtype: int64
- name: benzene_count
dtype: int64
- name: cyclohexane_count
dtype: int64
- name: 2H-pyran_count
dtype: int64
- name: 4H-pyran_count
dtype: int64
- name: 2H-pyran-2-one_count
dtype: int64
- name: 4H-pyran-4-one_count
dtype: int64
- name: 1,2-dioxin_count
dtype: int64
- name: 1,3-dioxin_count
dtype: int64
- name: pyridine_count
dtype: int64
- name: pyridazine_count
dtype: int64
- name: pyrimidine_count
dtype: int64
- name: pyrazine_count
dtype: int64
- name: piperazine_count
dtype: int64
- name: 1,3,5-triazine_count
dtype: int64
- name: 1,2,4-triazine_count
dtype: int64
- name: 1,2,3-triazine_count
dtype: int64
- name: 4H-1,2-Oxazine_count
dtype: int64
- name: 2H-1,3-Oxazine_count
dtype: int64
- name: 6H-1,3-Oxazine_count
dtype: int64
- name: 6H-1,2-Oxazine_count
dtype: int64
- name: 1,4-Oxazine_count
dtype: int64
- name: 2H-1,2-Oxazine_count
dtype: int64
- name: 4H-1,4-Oxazine_count
dtype: int64
- name: 1,2,5-Oxathiazine_count
dtype: int64
- name: 1,2,6-Oxathiazine_count
dtype: int64
- name: 1,2,4-Oxadiazine_count
dtype: int64
- name: 1,3,5-Oxadiazine_count
dtype: int64
- name: morpholine_count
dtype: int64
- name: azepine_count
dtype: int64
- name: oxepin_count
dtype: int64
- name: thiepin_count
dtype: int64
- name: 4H-1,2-diazepine_count
dtype: int64
- name: indene_count
dtype: int64
- name: 2H-indene_count
dtype: int64
- name: benzofuran_count
dtype: int64
- name: isobenzofuran_count
dtype: int64
- name: benzo[b]thiophene_count
dtype: int64
- name: benzo[c]thiophene_count
dtype: int64
- name: indole_count
dtype: int64
- name: 3H-indole_count
dtype: int64
- name: 1H-indole_count
dtype: int64
- name: cyclopenta[b]pyridine_count
dtype: int64
- name: pyrano[3,4-b]-pyrrole_count
dtype: int64
- name: indazole_count
dtype: int64
- name: benzisoxazole_count
dtype: int64
- name: benzoxazole_count
dtype: int64
- name: 2,1-benzisoxazole_count
dtype: int64
- name: naphthalene_count
dtype: int64
- name: 1,2,3,4-tetrahydronaphthalene_count
dtype: int64
- name: octahydronaphthalene_count
dtype: int64
- name: 2H-1-benzopyran_count
dtype: int64
- name: 2H-1-benzopyran-2-one_count
dtype: int64
- name: 4H-1-benzopyran-4-one_count
dtype: int64
- name: 1H-2-benzopyran-1-one_count
dtype: int64
- name: 3H-2-benzopyran-1-one_count
dtype: int64
- name: quinoline_count
dtype: int64
- name: isoquinoline_count
dtype: int64
- name: cinnoline_count
dtype: int64
- name: quinazoline_count
dtype: int64
- name: 1,8-napthyhridine_count
dtype: int64
- name: 1,7-napththyridine_count
dtype: int64
- name: 1,5-napththridine_count
dtype: int64
- name: 1,6-napthyridine_count
dtype: int64
- name: 2H-1,3-benzoxazine_count
dtype: int64
- name: 2H-1,4-benzoxazine_count
dtype: int64
- name: 1H-2,3-benzoxazine_count
dtype: int64
- name: 4H-3,1-benzoxazine_count
dtype: int64
- name: 2H-1,2-benzoxazine_count
dtype: int64
- name: 4H-1,3-benzoxazine_count
dtype: int64
- name: anthracene_count
dtype: int64
- name: phenanthrene_count
dtype: int64
- name: phenalene_count
dtype: int64
- name: fluorene_count
dtype: int64
- name: carbazole_count
dtype: int64
- name: xanthene_count
dtype: int64
- name: acridine_count
dtype: int64
- name: norpinane_count
dtype: int64
- name: 7H-purine_count
dtype: int64
- name: steroid_ring_system_count
dtype: int64
- name: imidazole_count
dtype: int64
- name: thiazol-2-amine_count
dtype: int64
- name: tetrazole_count
dtype: int64
- name: cytosine_count
dtype: int64
- name: adenine_count
dtype: int64
- name: 5-methylindole_count
dtype: int64
- name: isocaffeine_count
dtype: int64
- name: tetrazolethiol_count
dtype: int64
- name: 3-methylisoxazole_count
dtype: int64
- name: 1-methylimidazole_count
dtype: int64
- name: 2-methylimidazole_count
dtype: int64
- name: guanine_count
dtype: int64
- name: tosufloxacin_count
dtype: int64
- name: acetamido_count
dtype: int64
- name: acetoacetyl_count
dtype: int64
- name: acetyl_count
dtype: int64
- name: acryloyl_count
dtype: int64
- name: alanyl_count
dtype: int64
- name: beta-alanyl_count
dtype: int64
- name: allylidene_count
dtype: int64
- name: amidino_count
dtype: int64
- name: amino_count
dtype: int64
- name: amyl_count
dtype: int64
- name: anilino_count
dtype: int64
- name: anisidino_count
dtype: int64
- name: anthranoyl_count
dtype: int64
- name: arsino_count
dtype: int64
- name: azelaoyl_count
dtype: int64
- name: azido_count
dtype: int64
- name: azo_count
dtype: int64
- name: azoxy_count
dtype: int64
- name: benzal_count
dtype: int64
- name: benzamido_count
dtype: int64
- name: benzhydrol_count
dtype: int64
- name: benzoxy_count
dtype: int64
- name: benzoyl_count
dtype: int64
- name: benzylidene_count
dtype: int64
- name: benzylidyne_count
dtype: int64
- name: biphenylyl_count
dtype: int64
- name: biphenylene_count
dtype: int64
- name: butoxy_count
dtype: int64
- name: sec-butoxy_count
dtype: int64
- name: tert-butoxy_count
dtype: int64
- name: butyl_count
dtype: int64
- name: sec-butyl_count
dtype: int64
- name: butyryl_count
dtype: int64
- name: caproyl_count
dtype: int64
- name: capryl_count
dtype: int64
- name: capryloyl_count
dtype: int64
- name: carbamido_count
dtype: int64
- name: carbamoyl_count
dtype: int64
- name: carbamyl_count
dtype: int64
- name: carbazoyl_count
dtype: int64
- name: carbethoxy_count
dtype: int64
- name: carbonyl_count
dtype: int64
- name: carboxy_count
dtype: int64
- name: cetyl_count
dtype: int64
- name: chloroformyl_count
dtype: int64
- name: cinnamoyl_count
dtype: int64
- name: cinnamyl_count
dtype: int64
- name: cinnamylidene_count
dtype: int64
- name: cresyl_count
dtype: int64
- name: crotonoyl_count
dtype: int64
- name: crotyl_count
dtype: int64
- name: cyanamido_count
dtype: int64
- name: cyanato_count
dtype: int64
- name: cyano_count
dtype: int64
- name: decanedioyl_count
dtype: int64
- name: decanoyl_count
dtype: int64
- name: diazo_count
dtype: int64
- name: diazoamino_count
dtype: int64
- name: disilanyl_count
dtype: int64
- name: disiloxanyloxy_count
dtype: int64
- name: disulfinyl_count
dtype: int64
- name: dithio_count
dtype: int64
- name: enanthoyl_count
dtype: int64
- name: epoxy_count
dtype: int64
- name: ethenyl_count
dtype: int64
- name: ethynyl_count
dtype: int64
- name: ethoxy_count
dtype: int64
- name: ethylene_count
dtype: int64
- name: ethylidene_count
dtype: int64
- name: ethylthio_count
dtype: int64
- name: formamido_count
dtype: int64
- name: furmaroyl_count
dtype: int64
- name: furfuryl_count
dtype: int64
- name: furfurylidene_count
dtype: int64
- name: glutamoyl_count
dtype: int64
- name: glutaryl_count
dtype: int64
- name: glycylamino_count
dtype: int64
- name: glycoloyl_count
dtype: int64
- name: glycyl_count
dtype: int64
- name: glyoxyoyl_count
dtype: int64
- name: guanidino_count
dtype: int64
- name: guanyl_count
dtype: int64
- name: heptadecanoyl_count
dtype: int64
- name: heptanamido_count
dtype: int64
- name: heptanoyl_count
dtype: int64
- name: hexadecanoyl_count
dtype: int64
- name: hexamethylene_count
dtype: int64
- name: hexanedioyl_count
dtype: int64
- name: hippuryl_count
dtype: int64
- name: hydrazino_count
dtype: int64
- name: hydrazo_count
dtype: int64
- name: hydrocinnamoyl_count
dtype: int64
- name: hydroperoxy_count
dtype: int64
- name: hydroxyamino_count
dtype: int64
- name: imino_count
dtype: int64
- name: iodoso_count
dtype: int64
- name: iodyl_count
dtype: int64
- name: isoamyl_count
dtype: int64
- name: isobutenyl_count
dtype: int64
- name: isobutoxy_count
dtype: int64
- name: isobutyl_count
dtype: int64
- name: isobutylidene_count
dtype: int64
- name: isobutyryl_count
dtype: int64
- name: isocyanato_count
dtype: int64
- name: isocyano_count
dtype: int64
- name: isohexyl_count
dtype: int64
- name: isoleucyl_count
dtype: int64
- name: isonitroso_count
dtype: int64
- name: isopentyl_count
dtype: int64
- name: isopentylidene_count
dtype: int64
- name: isopropenyl_count
dtype: int64
- name: isopropoxy_count
dtype: int64
- name: isopropyl_count
dtype: int64
- name: isopropylidene_count
dtype: int64
- name: isothiocynato_count
dtype: int64
- name: isovaleryl_count
dtype: int64
- name: lactoyl_count
dtype: int64
- name: lauroyl_count
dtype: int64
- name: lauryl_count
dtype: int64
- name: leucyl_count
dtype: int64
- name: levulinoyl_count
dtype: int64
- name: malonyl_count
dtype: int64
- name: mandeloyl_count
dtype: int64
- name: mercapto_count
dtype: int64
- name: mesityl_count
dtype: int64
- name: methacryloyl_count
dtype: int64
- name: methallyl_count
dtype: int64
- name: methionyl_count
dtype: int64
- name: methoxy_count
dtype: int64
- name: methylene_count
dtype: int64
- name: methylthio_count
dtype: int64
- name: myristoyl_count
dtype: int64
- name: myristyl_count
dtype: int64
- name: naphthyl_count
dtype: int64
- name: naphthylene_count
dtype: int64
- name: neopentyl_count
dtype: int64
- name: nitramino_count
dtype: int64
- name: nitrosamino_count
dtype: int64
- name: nitroso_count
dtype: int64
- name: nonanoyl_count
dtype: int64
- name: oleoyl_count
dtype: int64
- name: oxalyl_count
dtype: int64
- name: oxo_count
dtype: int64
- name: palmitoyl_count
dtype: int64
- name: pentamethylene_count
dtype: int64
- name: pentyl_count
dtype: int64
- name: tert-pentyl_count
dtype: int64
- name: phenacylidene_count
dtype: int64
- name: phenethyl_count
dtype: int64
- name: phenoxy_count
dtype: int64
- name: phenyl_count
dtype: int64
- name: phenylene_count
dtype: int64
- name: phosphino_count
dtype: int64
- name: phosphinyl_count
dtype: int64
- name: phospho_count
dtype: int64
- name: phosphono_count
dtype: int64
- name: phthaloyl_count
dtype: int64
- name: picryl_count
dtype: int64
- name: pimeloyl_count
dtype: int64
- name: piperidino_count
dtype: int64
- name: pivaloyl_count
dtype: int64
- name: prenyl_count
dtype: int64
- name: propargyl_count
dtype: int64
- name: 1-propenyl_count
dtype: int64
- name: 2-propenyl_count
dtype: int64
- name: propionyl_count
dtype: int64
- name: propoxy_count
dtype: int64
- name: propyl_count
dtype: int64
- name: propylidene_count
dtype: int64
- name: pyrryl_count
dtype: int64
- name: salicyloyl_count
dtype: int64
- name: selenyl_count
dtype: int64
- name: seryl_count
dtype: int64
- name: siloxy_count
dtype: int64
- name: silyl_count
dtype: int64
- name: silyene_count
dtype: int64
- name: sorboyl_count
dtype: int64
- name: stearoyl_count
dtype: int64
- name: stearyl_count
dtype: int64
- name: styryl_count
dtype: int64
- name: suberoyl_count
dtype: int64
- name: succinyl_count
dtype: int64
- name: sulfamino_count
dtype: int64
- name: sulfamoyl_count
dtype: int64
- name: sulfanilyl_count
dtype: int64
- name: sulfeno_count
dtype: int64
- name: sulfhydryl_count
dtype: int64
- name: sulfinyl_count
dtype: int64
- name: sulfo_count
dtype: int64
- name: sulfonyl_count
dtype: int64
- name: terephthaloyl_count
dtype: int64
- name: tetramethylene_count
dtype: int64
- name: thienyl_count
dtype: int64
- name: thiocarbonyl_count
dtype: int64
- name: thiocarboxy_count
dtype: int64
- name: thiocyanato_count
dtype: int64
- name: thionyl_count
dtype: int64
- name: threonyl_count
dtype: int64
- name: toluidino_count
dtype: int64
- name: toluoyl_count
dtype: int64
- name: tolyl_count
dtype: int64
- name: alpha-tolyl_count
dtype: int64
- name: tolylene_count
dtype: int64
- name: tosyl_count
dtype: int64
- name: triazano_count
dtype: int64
- name: trimethylene_count
dtype: int64
- name: valeryl_count
dtype: int64
- name: valyl_count
dtype: int64
- name: vinyl_count
dtype: int64
- name: vinylidene_count
dtype: int64
- name: xylidino_count
dtype: int64
- name: xylyl_count
dtype: int64
- name: xylylene_count
dtype: int64
- name: propiolamide_count
dtype: int64
- name: fumarate ester_count
dtype: int64
- name: allenamide_count
dtype: int64
- name: propiolonitrile_count
dtype: int64
- name: propargylamide_count
dtype: int64
- name: arylsulfonyl bicyclobutane_count
dtype: int64
- name: haloalkane_count
dtype: int64
- name: alpha-halomethyl_count
dtype: int64
- name: alpha-haloamide_count
dtype: int64
- name: alpha-haloester_count
dtype: int64
- name: epoxide_count
dtype: int64
- name: aziridine_count
dtype: int64
- name: nitroalkane_count
dtype: int64
- name: acrylamide_count
dtype: int64
- name: cyanoenone_count
dtype: int64
- name: aldehyde_count
dtype: int64
- name: ketone_count
dtype: int64
- name: nitrile_count
dtype: int64
- name: cyanamide_count
dtype: int64
- name: isothicyanate_count
dtype: int64
- name: sulfone_count
dtype: int64
- name: sulfonyl fluoride_count
dtype: int64
- name: sulfonimidoyl fluoride_count
dtype: int64
- name: aryl fluorosulfate_count
dtype: int64
- name: ester_count
dtype: int64
- name: sulfonamide_count
dtype: int64
- name: 2-carbonyl arylboronic acid_count
dtype: int64
- name: n-methyl isoxazolium_count
dtype: int64
- name: oxaziridine_count
dtype: int64
- name: carboxyl_count
dtype: int64
- name: ether_count
dtype: int64
- name: alkanol_count
dtype: int64
- name: thiol_count
dtype: int64
- name: halogen_count
dtype: int64
- name: amine_count
dtype: int64
- name: amide_count
dtype: int64
- name: num_valence_electrons
dtype: int64
- name: rotable_proportion
dtype: float64
- name: non_rotable_proportion
dtype: float64
- name: num_unspecified_bond
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- name: num_single_bonds
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- name: num_triple_bonds
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- name: num_quadruple_bonds
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- name: num_quintuple_bonds
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- name: num_hextuple_bonds
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- name: num_oneandahalf_bonds
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- name: num_twoandahalf_bonds
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- name: num_threeandahalf_bonds
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- name: num_fourandahalf_bonds
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- name: num_fiveandahalf_bonds
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- name: num_aromatic_bonds
dtype: float64
- name: num_ionic_bonds
dtype: float64
- name: num_hydrogen_bonds
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- name: num_threecenter_bonds
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- name: num_dativeone_bonds
dtype: float64
- name: num_dative_bonds
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- name: num_other_bonds
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- name: num_zero_bonds
dtype: float64
- name: num_bonds
dtype: int64
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- name: carbon_mass
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- name: hydrogen_mass
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- name: nitrogen_mass
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- name: oxygen_mass
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- name: num_carbon_atoms
dtype: int64
- name: num_hydrogen_atoms
dtype: int64
- name: num_nitrogen_atoms
dtype: int64
- name: num_oxygen_atoms
dtype: int64
- name: num_hydrogen_bond_acceptors
dtype: int64
- name: num_hydrogen_bond_donors
dtype: int64
- name: num_lipinski_violations
dtype: int64
- name: inertial_shape_factor
dtype: float64
- name: eccentricity
dtype: float64
- name: asphericity
dtype: float64
- name: npr1_value
dtype: float64
- name: npr2_value
dtype: float64
- name: pmi1_value
dtype: float64
- name: pmi2_value
dtype: float64
- name: pmi3_value
dtype: float64
- name: num_chiral_centers
dtype: int64
- name: representation
dtype: string
splits:
- name: train
num_bytes: 2758973
num_examples: 499
download_size: 490161
dataset_size: 2758973
- config_name: rdkit_feat_4
features:
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dtype: int64
- name: representation_type
dtype: string
- name: trityl_count
dtype: int64
- name: 3,5-dimethoxyphenylisoproxycarbonyl_count
dtype: int64
- name: 2-(4-biphenyl)isopropoxycarbonyl_count
dtype: int64
- name: 2-nitrophenylsulfenyl_count
dtype: int64
- name: boc_count
dtype: int64
- name: trt_count
dtype: int64
- name: ddz_count
dtype: int64
- name: bpoc_count
dtype: int64
- name: nps_count
dtype: int64
- name: 9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: 2-(4-nitrophenylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: (1,1-dioxobenzo[b]thiophene-2-yl)methyloxycarbonyl_count
dtype: int64
- name: (1,1-dioxonaptho[1,2-b]thiophene-2-yl)methyloxycarbonyl_count
dtype: int64
- name: 1-(4,4-dimethyl-2,6-dioxocyclohex-1-ylidene)-3-methylbutyl_count
dtype: int64
- name: 2,7-di-tert-butyl-fmoc_count
dtype: int64
- name: 2-fluoro-fmoc_count
dtype: int64
- name: 2-monoisooctyl-fmoc_count
dtype: int64
- name: 2,7-diisooctyl-fmoc_count
dtype: int64
- name: tetrachlorophthaloyl_count
dtype: int64
- name: 2-[phenyl(methyl)sulfonio])ethyloxycarbonyltetrafluoroborate_count
dtype: int64
- name: ethanesulfonylethoxycarbonyl_count
dtype: int64
- name: 2-(4-sulfophenylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: fmoc_count
dtype: int64
- name: nsc_count
dtype: int64
- name: bsmoc_count
dtype: int64
- name: alpha-nsmoc_count
dtype: int64
- name: ivdde_count
dtype: int64
- name: fmoc*_count
dtype: int64
- name: fmoc(fmoc(2f))_count
dtype: int64
- name: mio-fmoc_count
dtype: int64
- name: dio-fmoc_count
dtype: int64
- name: tcp_count
dtype: int64
- name: pms_count
dtype: int64
- name: esc_count
dtype: int64
- name: sps_count
dtype: int64
- name: benzyloxycarbonyl_count
dtype: int64
- name: allyloxycarbonyl_count
dtype: int64
- name: o-nitrobenzenesulfonyl_count
dtype: int64
- name: 2,4-dinitrobenzenesulfonyl_count
dtype: int64
- name: benzothiazole-2-sulfonyl_count
dtype: int64
- name: 2,2,2-trichloroethyloxycarbonyl_count
dtype: int64
- name: dithiasuccinoyl_count
dtype: int64
- name: p-nitrobenzyloxycarbonyl_count
dtype: int64
- name: alpha-azidoacids_count
dtype: int64
- name: proparglyoxycarbonyl_count
dtype: int64
- name: o-nitrobenzylcarbonyl_count
dtype: int64
- name: 4-nitroveratryloxycarbonyl_count
dtype: int64
- name: 2-(2-nitrophenyl)propyloxycarbonyl_count
dtype: int64
- name: 2-(3,4-methylenedioxy-6-nitrophenyl)propyloxycarbonyl_count
dtype: int64
- name: 9-(4-bromophenyl)-9-fluorenyl_count
dtype: int64
- name: azidomethoxycarbonyl_count
dtype: int64
- name: hexafluoroacetone_count
dtype: int64
- name: Z_count
dtype: int64
- name: alloc_count
dtype: int64
- name: o-nbs_count
dtype: int64
- name: d-nbs_count
dtype: int64
- name: bts_count
dtype: int64
- name: troc_count
dtype: int64
- name: dts_count
dtype: int64
- name: pnz_count
dtype: int64
- name: poc_count
dtype: int64
- name: onz_count
dtype: int64
- name: nvoc_count
dtype: int64
- name: nppoc_count
dtype: int64
- name: mnppoc_count
dtype: int64
- name: brphf_count
dtype: int64
- name: azoc_count
dtype: int64
- name: hfa_count
dtype: int64
- name: 2-chlorobenzyloxycarbonyl_count
dtype: int64
- name: 4-methyltrityl_count
dtype: int64
- name: cl-z_count
dtype: int64
- name: mtt_count
dtype: int64
- name: 1-(4,4-dimethyl-2,6-dioxocylohex-1-ylidene)-3-methylbutyl_count
dtype: int64
- name: trifluoroacetyl_count
dtype: int64
- name: 2-(methylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: tfa_count
dtype: int64
- name: msc_count
dtype: int64
- name: phenyldisulphanylethyloxycarbonyl_count
dtype: int64
- name: 2-pyridyldisulphanylethyloxycarbonyl_count
dtype: int64
- name: phdec_count
dtype: int64
- name: pydec_count
dtype: int64
- name: tert-butyl_count
dtype: int64
- name: 2-chlorotrityl_count
dtype: int64
- name: 2-4-dimethyoxybenzyl_count
dtype: int64
- name: 2-phenylisopropyl_count
dtype: int64
- name: 5-phenyl-3,4-ethylenedioxythenyl_count
dtype: int64
- name: bu_count
dtype: int64
- name: 2-cl-trt_count
dtype: int64
- name: dmb_count
dtype: int64
- name: 2-ph-pr_count
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- name: phenyl-edotn_count
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- name: 9-fluorenylmethyl_count
dtype: int64
- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocylocheylidene)-3-methylbutyl]-amino)benzyl_count
dtype: int64
- name: methyl_count
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- name: ethyl_count
dtype: int64
- name: carbamoylmethyl_count
dtype: int64
- name: fm_count
dtype: int64
- name: dmab_count
dtype: int64
- name: me_count
dtype: int64
- name: et_count
dtype: int64
- name: cam_count
dtype: int64
- name: allyl_count
dtype: int64
- name: benzyl_count
dtype: int64
- name: phenacyl_count
dtype: int64
- name: p-nitrobenzyl_count
dtype: int64
- name: 2-trimethylsilyethyl_count
dtype: int64
- name: (2-phenyl-2-trimethylsilyl)ethyl_count
dtype: int64
- name: 2-(trimethylsilyl)isopropyl_count
dtype: int64
- name: 2,2,2-trichloroethyl_count
dtype: int64
- name: p-hydroxyphenacyl_count
dtype: int64
- name: 4,5-dimethyoxy-2-nitrobenzyl_count
dtype: int64
- name: 1,1-dimethylallyl_count
dtype: int64
- name: pentaaminecobalt_III_count
dtype: int64
- name: al_count
dtype: int64
- name: bn_count
dtype: int64
- name: pac_count
dtype: int64
- name: pnb_count
dtype: int64
- name: tmse_count
dtype: int64
- name: ptmse_count
dtype: int64
- name: tmsi_count
dtype: int64
- name: tce_count
dtype: int64
- name: php_count
dtype: int64
- name: dmnb_count
dtype: int64
- name: dma_count
dtype: int64
- name: cyclohexyl_count
dtype: int64
- name: b-menthyl_count
dtype: int64
- name: b-3-methylpent-3-yl_count
dtype: int64
- name: 4-(3,6,9-trioxadecyl)oxybenzyl_count
dtype: int64
- name: chx_count
dtype: int64
- name: men_count
dtype: int64
- name: mpe_count
dtype: int64
- name: tegbz_count
dtype: int64
- name: 9-fluoroenylmethyl_count
dtype: int64
- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-methyl-butyl]-amino)benzyl_count
dtype: int64
- name: trimethylsilylethyl_count
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- name: 4,5-dimethoxy-2-nitrobenzyloxycarbonyl_count
dtype: int64
- name: pseudoprolines_count
dtype: int64
- name: 2-hydroxy-4-methoxybenzyl_count
dtype: int64
- name: 2,4-dimethoxybenzyl_count
dtype: int64
- name: 2,4,6-trimethoxybenzyl_count
dtype: int64
- name: 1-methyl-3-indolylmethyl_count
dtype: int64
- name: 3,4-ethylene-dioxy-2-thenyl_count
dtype: int64
- name: hmb_count
dtype: int64
- name: tmob_count
dtype: int64
- name: mim_count
dtype: int64
- name: edot_count
dtype: int64
- name: 4-methoxy-2-nitro-benzyl_count
dtype: int64
- name: (6-hydroxy-3-oxido-1,3-benz[d]oxathiol-5-yl)methyl_count
dtype: int64
- name: 2-hydroxy-4-methoxy-5-(methylsulfinyl)benzyl_count
dtype: int64
- name: n-boc-n-methyl[2-(methylamino)ethyl]carbamoyl-hmb_count
dtype: int64
- name: 9-xanthenyl_count
dtype: int64
- name: cyclopropyldimethylcarbinyl_count
dtype: int64
- name: 4,4-dimethoxybenzhydryl_count
dtype: int64
- name: xan_count
dtype: int64
- name: cpd_count
dtype: int64
- name: mbh_count
dtype: int64
- name: p-toluenesulfonyl_count
dtype: int64
- name: 2,2,5,7,8-pentamethylchroman-6-sulfonyl_count
dtype: int64
- name: 2,2,4,6,7-pentamethyl-2,3-dihydrobenzofuran-5-sulfonyl_count
dtype: int64
- name: mesityl-2-sulfonyl_count
dtype: int64
- name: 4-methoxy-2,3,6-trimethylphenylsulfonyl_count
dtype: int64
- name: 1,2-dimethylindole-3-sulfonyl_count
dtype: int64
- name: w,w-bis-tert-butyloxycarbonyl_count
dtype: int64
- name: 5-dibenzosuberenyl_count
dtype: int64
- name: 5-dibenzosuberyl_count
dtype: int64
- name: 2-methoxy-5-dibenzosuberyl_count
dtype: int64
- name: nitro_count
dtype: int64
- name: tos_count
dtype: int64
- name: pmc_count
dtype: int64
- name: pbf_count
dtype: int64
- name: mts_count
dtype: int64
- name: mtr_count
dtype: int64
- name: mis_count
dtype: int64
- name: bis-boc_count
dtype: int64
- name: suben_count
dtype: int64
- name: sub_count
dtype: int64
- name: mesub_count
dtype: int64
- name: no2_count
dtype: int64
- name: w,w-bis-benzyloxycarbonyl_count
dtype: int64
- name: w,w-bis-allyloxycarbonyl_count
dtype: int64
- name: z-small_count
dtype: int64
- name: p-methylbenzyl_count
dtype: int64
- name: p-methoxybenzyl_count
dtype: int64
- name: monomethoxytrityl_count
dtype: int64
- name: trimethoxybenzyl_count
dtype: int64
- name: 2,2,4,6,7-pentamethyl-5-dihydrobenzofuranylmethyl_count
dtype: int64
- name: 1-adamantyl_count
dtype: int64
- name: meb_count
dtype: int64
- name: mob_count
dtype: int64
- name: mmt_count
dtype: int64
- name: pmbf_count
dtype: int64
- name: 1-ada_count
dtype: int64
- name: 2-(2,4-dinitrophenyl)ethyl_count
dtype: int64
- name: 9-fluororenylmethoxycarbonyl_count
dtype: int64
- name: dnpe_count
dtype: int64
- name: acetamidomethyl_count
dtype: int64
- name: phenylacetamidomethyl_count
dtype: int64
- name: 5-tert-butylmercapto_count
dtype: int64
- name: 3-nitro-2-pyridinesulfenyl_count
dtype: int64
- name: 2-pyridinesulfenyl_count
dtype: int64
- name: N-allyloxycarbonyl-N-[2,3,5,6-tetrafluoro-4-(phenylthio)phenyl]]aminomethyl_count
dtype: int64
- name: o-nitrobenzyl_count
dtype: int64
- name: 4-picolyl_count
dtype: int64
- name: ninhydrin_count
dtype: int64
- name: acm_count
dtype: int64
- name: phacm_count
dtype: int64
- name: sbu_count
dtype: int64
- name: npys_count
dtype: int64
- name: s-pyr_count
dtype: int64
- name: fsam_count
dtype: int64
- name: onb_count
dtype: int64
- name: nin_count
dtype: int64
- name: n-tosyl_count
dtype: int64
- name: n-trityl_count
dtype: int64
- name: n-monomethoxytrityl_count
dtype: int64
- name: n-methyltrityl_count
dtype: int64
- name: n-tert-butyloxycarbonyl_count
dtype: int64
- name: n-2,4-dimethylpent-3-yloxycarbonyl_count
dtype: int64
- name: n-benzyloxymethyl_count
dtype: int64
- name: n-tert-butoxymethyl_count
dtype: int64
- name: ntos_count
dtype: int64
- name: ntrt_count
dtype: int64
- name: nmtt_count
dtype: int64
- name: nmmt_count
dtype: int64
- name: nboc_count
dtype: int64
- name: ndoc_count
dtype: int64
- name: nbom_count
dtype: int64
- name: nbum_count
dtype: int64
- name: N-9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: N-2,6-dimethoxybenzoyl_count
dtype: int64
- name: dmbz_count
dtype: int64
- name: N-2,4-dinitrophenyl_count
dtype: int64
- name: dnp_count
dtype: int64
- name: cyclohexyl;_count
dtype: int64
- name: tert-butyldimethylsilyl_count
dtype: int64
- name: tbdms_count
dtype: int64
- name: tert-butyldiphenylsilyl_count
dtype: int64
- name: propargyloxycarbonyl_count
dtype: int64
- name: tbdps_count
dtype: int64
- name: 2,6-dichlorobenzyl_count
dtype: int64
- name: 2-bromobenzyl_count
dtype: int64
- name: 2-bromobenzyloxycarbonyl_count
dtype: int64
- name: 3-pentyl_count
dtype: int64
- name: dcb_count
dtype: int64
- name: brbn_count
dtype: int64
- name: brz_count
dtype: int64
- name: pen_count
dtype: int64
- name: tegb_count
dtype: int64
- name: boc-n-methyl-n-[2-(methylamino)ethyl]carbamoyl_count
dtype: int64
- name: boc-nmec_count
dtype: int64
- name: formyl_count
dtype: int64
- name: cyclohexyloxycarbonyl_count
dtype: int64
- name: for_count
dtype: int64
- name: hoc_count
dtype: int64
- name: cyclopropane_count
dtype: int64
- name: spiropentane_count
dtype: int64
- name: cyclobutane_count
dtype: int64
- name: cyclopentane_count
dtype: int64
- name: furan_count
dtype: int64
- name: thiophene_count
dtype: int64
- name: pyrrole_count
dtype: int64
- name: 2H-pyrrole_count
dtype: int64
- name: 3H-pyrrole_count
dtype: int64
- name: pyrazole_count
dtype: int64
- name: 2H-imidazole_count
dtype: int64
- name: 1,2,3-triazole_count
dtype: int64
- name: 1,2,4-triazole_count
dtype: int64
- name: 1,2-dithiole_count
dtype: int64
- name: 1,3-dithiole_count
dtype: int64
- name: 3H-1,2-oxathiole_count
dtype: int64
- name: isoxazole_count
dtype: int64
- name: oxazole_count
dtype: int64
- name: thiazole_count
dtype: int64
- name: isothiazole_count
dtype: int64
- name: 1,2,3-oxadiazole_count
dtype: int64
- name: 1,2,4-oxadiazole_count
dtype: int64
- name: 1,2,5-oxadiazole_count
dtype: int64
- name: 1,3,4-oxadiazole_count
dtype: int64
- name: 1,2,3,4-oxatriazole_count
dtype: int64
- name: 1,2,3,5-oxatriazole_count
dtype: int64
- name: 3H-1,2,3-dioxazole_count
dtype: int64
- name: 1,2,4-dioxazole_count
dtype: int64
- name: 1,3,2-dioxazole_count
dtype: int64
- name: 1,3,4-dioxazole_count
dtype: int64
- name: 5H-1,2,5-oxathiazole_count
dtype: int64
- name: 1,3-oxathiole_count
dtype: int64
- name: benzene_count
dtype: int64
- name: cyclohexane_count
dtype: int64
- name: 2H-pyran_count
dtype: int64
- name: 4H-pyran_count
dtype: int64
- name: 2H-pyran-2-one_count
dtype: int64
- name: 4H-pyran-4-one_count
dtype: int64
- name: 1,2-dioxin_count
dtype: int64
- name: 1,3-dioxin_count
dtype: int64
- name: pyridine_count
dtype: int64
- name: pyridazine_count
dtype: int64
- name: pyrimidine_count
dtype: int64
- name: pyrazine_count
dtype: int64
- name: piperazine_count
dtype: int64
- name: 1,3,5-triazine_count
dtype: int64
- name: 1,2,4-triazine_count
dtype: int64
- name: 1,2,3-triazine_count
dtype: int64
- name: 4H-1,2-Oxazine_count
dtype: int64
- name: 2H-1,3-Oxazine_count
dtype: int64
- name: 6H-1,3-Oxazine_count
dtype: int64
- name: 6H-1,2-Oxazine_count
dtype: int64
- name: 1,4-Oxazine_count
dtype: int64
- name: 2H-1,2-Oxazine_count
dtype: int64
- name: 4H-1,4-Oxazine_count
dtype: int64
- name: 1,2,5-Oxathiazine_count
dtype: int64
- name: 1,2,6-Oxathiazine_count
dtype: int64
- name: 1,2,4-Oxadiazine_count
dtype: int64
- name: 1,3,5-Oxadiazine_count
dtype: int64
- name: morpholine_count
dtype: int64
- name: azepine_count
dtype: int64
- name: oxepin_count
dtype: int64
- name: thiepin_count
dtype: int64
- name: 4H-1,2-diazepine_count
dtype: int64
- name: indene_count
dtype: int64
- name: 2H-indene_count
dtype: int64
- name: benzofuran_count
dtype: int64
- name: isobenzofuran_count
dtype: int64
- name: benzo[b]thiophene_count
dtype: int64
- name: benzo[c]thiophene_count
dtype: int64
- name: indole_count
dtype: int64
- name: 3H-indole_count
dtype: int64
- name: 1H-indole_count
dtype: int64
- name: cyclopenta[b]pyridine_count
dtype: int64
- name: pyrano[3,4-b]-pyrrole_count
dtype: int64
- name: indazole_count
dtype: int64
- name: benzisoxazole_count
dtype: int64
- name: benzoxazole_count
dtype: int64
- name: 2,1-benzisoxazole_count
dtype: int64
- name: naphthalene_count
dtype: int64
- name: 1,2,3,4-tetrahydronaphthalene_count
dtype: int64
- name: octahydronaphthalene_count
dtype: int64
- name: 2H-1-benzopyran_count
dtype: int64
- name: 2H-1-benzopyran-2-one_count
dtype: int64
- name: 4H-1-benzopyran-4-one_count
dtype: int64
- name: 1H-2-benzopyran-1-one_count
dtype: int64
- name: 3H-2-benzopyran-1-one_count
dtype: int64
- name: quinoline_count
dtype: int64
- name: isoquinoline_count
dtype: int64
- name: cinnoline_count
dtype: int64
- name: quinazoline_count
dtype: int64
- name: 1,8-napthyhridine_count
dtype: int64
- name: 1,7-napththyridine_count
dtype: int64
- name: 1,5-napththridine_count
dtype: int64
- name: 1,6-napthyridine_count
dtype: int64
- name: 2H-1,3-benzoxazine_count
dtype: int64
- name: 2H-1,4-benzoxazine_count
dtype: int64
- name: 1H-2,3-benzoxazine_count
dtype: int64
- name: 4H-3,1-benzoxazine_count
dtype: int64
- name: 2H-1,2-benzoxazine_count
dtype: int64
- name: 4H-1,3-benzoxazine_count
dtype: int64
- name: anthracene_count
dtype: int64
- name: phenanthrene_count
dtype: int64
- name: phenalene_count
dtype: int64
- name: fluorene_count
dtype: int64
- name: carbazole_count
dtype: int64
- name: xanthene_count
dtype: int64
- name: acridine_count
dtype: int64
- name: norpinane_count
dtype: int64
- name: 7H-purine_count
dtype: int64
- name: steroid_ring_system_count
dtype: int64
- name: imidazole_count
dtype: int64
- name: thiazol-2-amine_count
dtype: int64
- name: tetrazole_count
dtype: int64
- name: cytosine_count
dtype: int64
- name: adenine_count
dtype: int64
- name: 5-methylindole_count
dtype: int64
- name: isocaffeine_count
dtype: int64
- name: tetrazolethiol_count
dtype: int64
- name: 3-methylisoxazole_count
dtype: int64
- name: 1-methylimidazole_count
dtype: int64
- name: 2-methylimidazole_count
dtype: int64
- name: guanine_count
dtype: int64
- name: tosufloxacin_count
dtype: int64
- name: acetamido_count
dtype: int64
- name: acetoacetyl_count
dtype: int64
- name: acetyl_count
dtype: int64
- name: acryloyl_count
dtype: int64
- name: alanyl_count
dtype: int64
- name: beta-alanyl_count
dtype: int64
- name: allylidene_count
dtype: int64
- name: amidino_count
dtype: int64
- name: amino_count
dtype: int64
- name: amyl_count
dtype: int64
- name: anilino_count
dtype: int64
- name: anisidino_count
dtype: int64
- name: anthranoyl_count
dtype: int64
- name: arsino_count
dtype: int64
- name: azelaoyl_count
dtype: int64
- name: azido_count
dtype: int64
- name: azo_count
dtype: int64
- name: azoxy_count
dtype: int64
- name: benzal_count
dtype: int64
- name: benzamido_count
dtype: int64
- name: benzhydrol_count
dtype: int64
- name: benzoxy_count
dtype: int64
- name: benzoyl_count
dtype: int64
- name: benzylidene_count
dtype: int64
- name: benzylidyne_count
dtype: int64
- name: biphenylyl_count
dtype: int64
- name: biphenylene_count
dtype: int64
- name: butoxy_count
dtype: int64
- name: sec-butoxy_count
dtype: int64
- name: tert-butoxy_count
dtype: int64
- name: butyl_count
dtype: int64
- name: sec-butyl_count
dtype: int64
- name: butyryl_count
dtype: int64
- name: caproyl_count
dtype: int64
- name: capryl_count
dtype: int64
- name: capryloyl_count
dtype: int64
- name: carbamido_count
dtype: int64
- name: carbamoyl_count
dtype: int64
- name: carbamyl_count
dtype: int64
- name: carbazoyl_count
dtype: int64
- name: carbethoxy_count
dtype: int64
- name: carbonyl_count
dtype: int64
- name: carboxy_count
dtype: int64
- name: cetyl_count
dtype: int64
- name: chloroformyl_count
dtype: int64
- name: cinnamoyl_count
dtype: int64
- name: cinnamyl_count
dtype: int64
- name: cinnamylidene_count
dtype: int64
- name: cresyl_count
dtype: int64
- name: crotonoyl_count
dtype: int64
- name: crotyl_count
dtype: int64
- name: cyanamido_count
dtype: int64
- name: cyanato_count
dtype: int64
- name: cyano_count
dtype: int64
- name: decanedioyl_count
dtype: int64
- name: decanoyl_count
dtype: int64
- name: diazo_count
dtype: int64
- name: diazoamino_count
dtype: int64
- name: disilanyl_count
dtype: int64
- name: disiloxanyloxy_count
dtype: int64
- name: disulfinyl_count
dtype: int64
- name: dithio_count
dtype: int64
- name: enanthoyl_count
dtype: int64
- name: epoxy_count
dtype: int64
- name: ethenyl_count
dtype: int64
- name: ethynyl_count
dtype: int64
- name: ethoxy_count
dtype: int64
- name: ethylene_count
dtype: int64
- name: ethylidene_count
dtype: int64
- name: ethylthio_count
dtype: int64
- name: formamido_count
dtype: int64
- name: furmaroyl_count
dtype: int64
- name: furfuryl_count
dtype: int64
- name: furfurylidene_count
dtype: int64
- name: glutamoyl_count
dtype: int64
- name: glutaryl_count
dtype: int64
- name: glycylamino_count
dtype: int64
- name: glycoloyl_count
dtype: int64
- name: glycyl_count
dtype: int64
- name: glyoxyoyl_count
dtype: int64
- name: guanidino_count
dtype: int64
- name: guanyl_count
dtype: int64
- name: heptadecanoyl_count
dtype: int64
- name: heptanamido_count
dtype: int64
- name: heptanoyl_count
dtype: int64
- name: hexadecanoyl_count
dtype: int64
- name: hexamethylene_count
dtype: int64
- name: hexanedioyl_count
dtype: int64
- name: hippuryl_count
dtype: int64
- name: hydrazino_count
dtype: int64
- name: hydrazo_count
dtype: int64
- name: hydrocinnamoyl_count
dtype: int64
- name: hydroperoxy_count
dtype: int64
- name: hydroxyamino_count
dtype: int64
- name: imino_count
dtype: int64
- name: iodoso_count
dtype: int64
- name: iodyl_count
dtype: int64
- name: isoamyl_count
dtype: int64
- name: isobutenyl_count
dtype: int64
- name: isobutoxy_count
dtype: int64
- name: isobutyl_count
dtype: int64
- name: isobutylidene_count
dtype: int64
- name: isobutyryl_count
dtype: int64
- name: isocyanato_count
dtype: int64
- name: isocyano_count
dtype: int64
- name: isohexyl_count
dtype: int64
- name: isoleucyl_count
dtype: int64
- name: isonitroso_count
dtype: int64
- name: isopentyl_count
dtype: int64
- name: isopentylidene_count
dtype: int64
- name: isopropenyl_count
dtype: int64
- name: isopropoxy_count
dtype: int64
- name: isopropyl_count
dtype: int64
- name: isopropylidene_count
dtype: int64
- name: isothiocynato_count
dtype: int64
- name: isovaleryl_count
dtype: int64
- name: lactoyl_count
dtype: int64
- name: lauroyl_count
dtype: int64
- name: lauryl_count
dtype: int64
- name: leucyl_count
dtype: int64
- name: levulinoyl_count
dtype: int64
- name: malonyl_count
dtype: int64
- name: mandeloyl_count
dtype: int64
- name: mercapto_count
dtype: int64
- name: mesityl_count
dtype: int64
- name: methacryloyl_count
dtype: int64
- name: methallyl_count
dtype: int64
- name: methionyl_count
dtype: int64
- name: methoxy_count
dtype: int64
- name: methylene_count
dtype: int64
- name: methylthio_count
dtype: int64
- name: myristoyl_count
dtype: int64
- name: myristyl_count
dtype: int64
- name: naphthyl_count
dtype: int64
- name: naphthylene_count
dtype: int64
- name: neopentyl_count
dtype: int64
- name: nitramino_count
dtype: int64
- name: nitrosamino_count
dtype: int64
- name: nitroso_count
dtype: int64
- name: nonanoyl_count
dtype: int64
- name: oleoyl_count
dtype: int64
- name: oxalyl_count
dtype: int64
- name: oxo_count
dtype: int64
- name: palmitoyl_count
dtype: int64
- name: pentamethylene_count
dtype: int64
- name: pentyl_count
dtype: int64
- name: tert-pentyl_count
dtype: int64
- name: phenacylidene_count
dtype: int64
- name: phenethyl_count
dtype: int64
- name: phenoxy_count
dtype: int64
- name: phenyl_count
dtype: int64
- name: phenylene_count
dtype: int64
- name: phosphino_count
dtype: int64
- name: phosphinyl_count
dtype: int64
- name: phospho_count
dtype: int64
- name: phosphono_count
dtype: int64
- name: phthaloyl_count
dtype: int64
- name: picryl_count
dtype: int64
- name: pimeloyl_count
dtype: int64
- name: piperidino_count
dtype: int64
- name: pivaloyl_count
dtype: int64
- name: prenyl_count
dtype: int64
- name: propargyl_count
dtype: int64
- name: 1-propenyl_count
dtype: int64
- name: 2-propenyl_count
dtype: int64
- name: propionyl_count
dtype: int64
- name: propoxy_count
dtype: int64
- name: propyl_count
dtype: int64
- name: propylidene_count
dtype: int64
- name: pyrryl_count
dtype: int64
- name: salicyloyl_count
dtype: int64
- name: selenyl_count
dtype: int64
- name: seryl_count
dtype: int64
- name: siloxy_count
dtype: int64
- name: silyl_count
dtype: int64
- name: silyene_count
dtype: int64
- name: sorboyl_count
dtype: int64
- name: stearoyl_count
dtype: int64
- name: stearyl_count
dtype: int64
- name: styryl_count
dtype: int64
- name: suberoyl_count
dtype: int64
- name: succinyl_count
dtype: int64
- name: sulfamino_count
dtype: int64
- name: sulfamoyl_count
dtype: int64
- name: sulfanilyl_count
dtype: int64
- name: sulfeno_count
dtype: int64
- name: sulfhydryl_count
dtype: int64
- name: sulfinyl_count
dtype: int64
- name: sulfo_count
dtype: int64
- name: sulfonyl_count
dtype: int64
- name: terephthaloyl_count
dtype: int64
- name: tetramethylene_count
dtype: int64
- name: thienyl_count
dtype: int64
- name: thiocarbonyl_count
dtype: int64
- name: thiocarboxy_count
dtype: int64
- name: thiocyanato_count
dtype: int64
- name: thionyl_count
dtype: int64
- name: threonyl_count
dtype: int64
- name: toluidino_count
dtype: int64
- name: toluoyl_count
dtype: int64
- name: tolyl_count
dtype: int64
- name: alpha-tolyl_count
dtype: int64
- name: tolylene_count
dtype: int64
- name: tosyl_count
dtype: int64
- name: triazano_count
dtype: int64
- name: trimethylene_count
dtype: int64
- name: valeryl_count
dtype: int64
- name: valyl_count
dtype: int64
- name: vinyl_count
dtype: int64
- name: vinylidene_count
dtype: int64
- name: xylidino_count
dtype: int64
- name: xylyl_count
dtype: int64
- name: xylylene_count
dtype: int64
- name: propiolamide_count
dtype: int64
- name: fumarate ester_count
dtype: int64
- name: allenamide_count
dtype: int64
- name: propiolonitrile_count
dtype: int64
- name: propargylamide_count
dtype: int64
- name: arylsulfonyl bicyclobutane_count
dtype: int64
- name: haloalkane_count
dtype: int64
- name: alpha-halomethyl_count
dtype: int64
- name: alpha-haloamide_count
dtype: int64
- name: alpha-haloester_count
dtype: int64
- name: epoxide_count
dtype: int64
- name: aziridine_count
dtype: int64
- name: nitroalkane_count
dtype: int64
- name: acrylamide_count
dtype: int64
- name: cyanoenone_count
dtype: int64
- name: aldehyde_count
dtype: int64
- name: ketone_count
dtype: int64
- name: nitrile_count
dtype: int64
- name: cyanamide_count
dtype: int64
- name: isothicyanate_count
dtype: int64
- name: sulfone_count
dtype: int64
- name: sulfonyl fluoride_count
dtype: int64
- name: sulfonimidoyl fluoride_count
dtype: int64
- name: aryl fluorosulfate_count
dtype: int64
- name: ester_count
dtype: int64
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- name: halogen_count
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- name: amine_count
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- name: num_fiveandahalf_bonds
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- name: num_aromatic_bonds
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- name: num_hydrogen_bonds
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- name: num_threecenter_bonds
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- name: num_dativeone_bonds
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- name: num_dative_bonds
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- name: num_hydrogen_atoms
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- name: num_nitrogen_atoms
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- name: num_oxygen_atoms
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- name: num_hydrogen_bond_acceptors
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- name: num_hydrogen_bond_donors
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- name: num_lipinski_violations
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- name: inertial_shape_factor
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- name: npr1_value
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- name: npr2_value
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- name: pmi1_value
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- name: pmi2_value
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- name: pmi3_value
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- name: num_chiral_centers
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- name: representation
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splits:
- name: train
num_bytes: 2763808
num_examples: 500
download_size: 520434
dataset_size: 2763808
- config_name: rdkit_feat_5
features:
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dtype: int64
- name: representation_type
dtype: string
- name: trityl_count
dtype: int64
- name: 3,5-dimethoxyphenylisoproxycarbonyl_count
dtype: int64
- name: 2-(4-biphenyl)isopropoxycarbonyl_count
dtype: int64
- name: 2-nitrophenylsulfenyl_count
dtype: int64
- name: boc_count
dtype: int64
- name: trt_count
dtype: int64
- name: ddz_count
dtype: int64
- name: bpoc_count
dtype: int64
- name: nps_count
dtype: int64
- name: 9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: 2-(4-nitrophenylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: (1,1-dioxobenzo[b]thiophene-2-yl)methyloxycarbonyl_count
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- name: (1,1-dioxonaptho[1,2-b]thiophene-2-yl)methyloxycarbonyl_count
dtype: int64
- name: 1-(4,4-dimethyl-2,6-dioxocyclohex-1-ylidene)-3-methylbutyl_count
dtype: int64
- name: 2,7-di-tert-butyl-fmoc_count
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- name: 2-fluoro-fmoc_count
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- name: 2-monoisooctyl-fmoc_count
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- name: 2,7-diisooctyl-fmoc_count
dtype: int64
- name: tetrachlorophthaloyl_count
dtype: int64
- name: 2-[phenyl(methyl)sulfonio])ethyloxycarbonyltetrafluoroborate_count
dtype: int64
- name: ethanesulfonylethoxycarbonyl_count
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- name: 2-(4-sulfophenylsulfonyl)ethoxycarbonyl_count
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- name: fmoc_count
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- name: nsc_count
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- name: bsmoc_count
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- name: alpha-nsmoc_count
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- name: ivdde_count
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- name: fmoc*_count
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- name: fmoc(fmoc(2f))_count
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- name: mio-fmoc_count
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- name: dio-fmoc_count
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- name: tcp_count
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- name: pms_count
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- name: esc_count
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- name: sps_count
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- name: benzyloxycarbonyl_count
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- name: allyloxycarbonyl_count
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- name: o-nitrobenzenesulfonyl_count
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- name: 2,4-dinitrobenzenesulfonyl_count
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- name: benzothiazole-2-sulfonyl_count
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- name: 2,2,2-trichloroethyloxycarbonyl_count
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- name: dithiasuccinoyl_count
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- name: p-nitrobenzyloxycarbonyl_count
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- name: alpha-azidoacids_count
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- name: proparglyoxycarbonyl_count
dtype: int64
- name: o-nitrobenzylcarbonyl_count
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- name: 4-nitroveratryloxycarbonyl_count
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- name: 2-(2-nitrophenyl)propyloxycarbonyl_count
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- name: 2-(3,4-methylenedioxy-6-nitrophenyl)propyloxycarbonyl_count
dtype: int64
- name: 9-(4-bromophenyl)-9-fluorenyl_count
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- name: azidomethoxycarbonyl_count
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- name: hexafluoroacetone_count
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- name: Z_count
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- name: alloc_count
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- name: o-nbs_count
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- name: d-nbs_count
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- name: bts_count
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- name: troc_count
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- name: dts_count
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- name: pnz_count
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- name: poc_count
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- name: onz_count
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- name: nvoc_count
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- name: nppoc_count
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- name: mnppoc_count
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- name: brphf_count
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- name: azoc_count
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- name: hfa_count
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- name: 2-chlorobenzyloxycarbonyl_count
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- name: 4-methyltrityl_count
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- name: cl-z_count
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- name: mtt_count
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- name: 1-(4,4-dimethyl-2,6-dioxocylohex-1-ylidene)-3-methylbutyl_count
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- name: trifluoroacetyl_count
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- name: 2-(methylsulfonyl)ethoxycarbonyl_count
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- name: tfa_count
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- name: msc_count
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- name: phenyldisulphanylethyloxycarbonyl_count
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- name: 2-pyridyldisulphanylethyloxycarbonyl_count
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- name: phdec_count
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- name: pydec_count
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- name: tert-butyl_count
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- name: 2-chlorotrityl_count
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- name: 2-4-dimethyoxybenzyl_count
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- name: 2-phenylisopropyl_count
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- name: 5-phenyl-3,4-ethylenedioxythenyl_count
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- name: bu_count
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- name: 2-cl-trt_count
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- name: dmb_count
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- name: 2-ph-pr_count
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- name: phenyl-edotn_count
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- name: 9-fluorenylmethyl_count
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- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocylocheylidene)-3-methylbutyl]-amino)benzyl_count
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- name: methyl_count
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- name: ethyl_count
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- name: carbamoylmethyl_count
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- name: dmab_count
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- name: me_count
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- name: et_count
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- name: cam_count
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- name: allyl_count
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- name: benzyl_count
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- name: phenacyl_count
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- name: p-nitrobenzyl_count
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- name: 2-trimethylsilyethyl_count
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- name: 2-(trimethylsilyl)isopropyl_count
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- name: 2,2,2-trichloroethyl_count
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- name: p-hydroxyphenacyl_count
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- name: 4,5-dimethyoxy-2-nitrobenzyl_count
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- name: 1,1-dimethylallyl_count
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- name: pentaaminecobalt_III_count
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- name: al_count
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- name: bn_count
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- name: pac_count
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- name: pnb_count
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- name: tmse_count
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- name: ptmse_count
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- name: tmsi_count
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- name: tce_count
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- name: php_count
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- name: dmnb_count
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- name: dma_count
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- name: cyclohexyl_count
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- name: b-menthyl_count
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- name: b-3-methylpent-3-yl_count
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- name: 4-(3,6,9-trioxadecyl)oxybenzyl_count
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- name: chx_count
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- name: men_count
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- name: mpe_count
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- name: tegbz_count
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- name: 9-fluoroenylmethyl_count
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- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-methyl-butyl]-amino)benzyl_count
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- name: 4,5-dimethoxy-2-nitrobenzyloxycarbonyl_count
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- name: pseudoprolines_count
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- name: 2-hydroxy-4-methoxybenzyl_count
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- name: 2,4-dimethoxybenzyl_count
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- name: 2,4,6-trimethoxybenzyl_count
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- name: hmb_count
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- name: tmob_count
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- name: mim_count
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- name: edot_count
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- name: (6-hydroxy-3-oxido-1,3-benz[d]oxathiol-5-yl)methyl_count
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- name: 2,2,4,6,7-pentamethyl-2,3-dihydrobenzofuran-5-sulfonyl_count
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- name: 4-methoxy-2,3,6-trimethylphenylsulfonyl_count
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- name: 1,2-dimethylindole-3-sulfonyl_count
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- name: w,w-bis-tert-butyloxycarbonyl_count
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- name: 5-dibenzosuberenyl_count
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- name: 5-dibenzosuberyl_count
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- name: 2-methoxy-5-dibenzosuberyl_count
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- name: pmc_count
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- name: pbf_count
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- name: mts_count
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- name: mtr_count
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- name: mis_count
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- name: bis-boc_count
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- name: suben_count
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- name: sub_count
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- name: mesub_count
dtype: int64
- name: no2_count
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- name: w,w-bis-benzyloxycarbonyl_count
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- name: w,w-bis-allyloxycarbonyl_count
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- name: z-small_count
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- name: p-methylbenzyl_count
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- name: monomethoxytrityl_count
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- name: trimethoxybenzyl_count
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- name: 2,2,4,6,7-pentamethyl-5-dihydrobenzofuranylmethyl_count
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- name: mob_count
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- name: mmt_count
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- name: pmbf_count
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- name: 2-(2,4-dinitrophenyl)ethyl_count
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- name: 9-fluororenylmethoxycarbonyl_count
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- name: acetamidomethyl_count
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- name: phenylacetamidomethyl_count
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- name: 5-tert-butylmercapto_count
dtype: int64
- name: 3-nitro-2-pyridinesulfenyl_count
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- name: 2-pyridinesulfenyl_count
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dtype: int64
- name: o-nitrobenzyl_count
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- name: 4-picolyl_count
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- name: ninhydrin_count
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- name: acm_count
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- name: phacm_count
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- name: sbu_count
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- name: npys_count
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- name: s-pyr_count
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- name: fsam_count
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- name: onb_count
dtype: int64
- name: nin_count
dtype: int64
- name: n-tosyl_count
dtype: int64
- name: n-trityl_count
dtype: int64
- name: n-monomethoxytrityl_count
dtype: int64
- name: n-methyltrityl_count
dtype: int64
- name: n-tert-butyloxycarbonyl_count
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- name: n-2,4-dimethylpent-3-yloxycarbonyl_count
dtype: int64
- name: n-benzyloxymethyl_count
dtype: int64
- name: n-tert-butoxymethyl_count
dtype: int64
- name: ntos_count
dtype: int64
- name: ntrt_count
dtype: int64
- name: nmtt_count
dtype: int64
- name: nmmt_count
dtype: int64
- name: nboc_count
dtype: int64
- name: ndoc_count
dtype: int64
- name: nbom_count
dtype: int64
- name: nbum_count
dtype: int64
- name: N-9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: N-2,6-dimethoxybenzoyl_count
dtype: int64
- name: dmbz_count
dtype: int64
- name: N-2,4-dinitrophenyl_count
dtype: int64
- name: dnp_count
dtype: int64
- name: cyclohexyl;_count
dtype: int64
- name: tert-butyldimethylsilyl_count
dtype: int64
- name: tbdms_count
dtype: int64
- name: tert-butyldiphenylsilyl_count
dtype: int64
- name: propargyloxycarbonyl_count
dtype: int64
- name: tbdps_count
dtype: int64
- name: 2,6-dichlorobenzyl_count
dtype: int64
- name: 2-bromobenzyl_count
dtype: int64
- name: 2-bromobenzyloxycarbonyl_count
dtype: int64
- name: 3-pentyl_count
dtype: int64
- name: dcb_count
dtype: int64
- name: brbn_count
dtype: int64
- name: brz_count
dtype: int64
- name: pen_count
dtype: int64
- name: tegb_count
dtype: int64
- name: boc-n-methyl-n-[2-(methylamino)ethyl]carbamoyl_count
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- name: boc-nmec_count
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- name: formyl_count
dtype: int64
- name: cyclohexyloxycarbonyl_count
dtype: int64
- name: for_count
dtype: int64
- name: hoc_count
dtype: int64
- name: cyclopropane_count
dtype: int64
- name: spiropentane_count
dtype: int64
- name: cyclobutane_count
dtype: int64
- name: cyclopentane_count
dtype: int64
- name: furan_count
dtype: int64
- name: thiophene_count
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- name: pyrrole_count
dtype: int64
- name: 2H-pyrrole_count
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- name: 3H-pyrrole_count
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- name: pyrazole_count
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- name: 2H-imidazole_count
dtype: int64
- name: 1,2,3-triazole_count
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- name: 1,2,4-triazole_count
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- name: 3H-1,2-oxathiole_count
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- name: isoxazole_count
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- name: oxazole_count
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- name: isothiazole_count
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- name: 1,2,3-oxadiazole_count
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- name: 1,2,4-oxadiazole_count
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- name: 1,2,5-oxadiazole_count
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- name: 1,2,3,4-oxatriazole_count
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- name: 1,2,3,5-oxatriazole_count
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- name: 3H-1,2,3-dioxazole_count
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- name: 1,3,2-dioxazole_count
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- name: 1,3,4-dioxazole_count
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- name: cyclohexane_count
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- name: 4H-pyran_count
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- name: 4H-pyran-4-one_count
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- name: 1,3-dioxin_count
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- name: pyridine_count
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- name: pyridazine_count
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- name: pyrimidine_count
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- name: pyrazine_count
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- name: piperazine_count
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- name: 1,3,5-triazine_count
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- name: 1,2,4-triazine_count
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- name: 1,2,3-triazine_count
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- name: 4H-1,2-Oxazine_count
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- name: 2H-1,3-Oxazine_count
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- name: 6H-1,3-Oxazine_count
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- name: 6H-1,2-Oxazine_count
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- name: 1,4-Oxazine_count
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- name: 2H-1,2-Oxazine_count
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- name: 4H-1,4-Oxazine_count
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- name: 1,2,5-Oxathiazine_count
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- name: 1,2,6-Oxathiazine_count
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- name: 1,2,4-Oxadiazine_count
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- name: 1,3,5-Oxadiazine_count
dtype: int64
- name: morpholine_count
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- name: azepine_count
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- name: oxepin_count
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- name: thiepin_count
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- name: 4H-1,2-diazepine_count
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- name: indene_count
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- name: 2H-indene_count
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- name: benzofuran_count
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- name: isobenzofuran_count
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- name: benzo[b]thiophene_count
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- name: benzo[c]thiophene_count
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- name: indole_count
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- name: 3H-indole_count
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- name: 1H-indole_count
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- name: cyclopenta[b]pyridine_count
dtype: int64
- name: pyrano[3,4-b]-pyrrole_count
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- name: indazole_count
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- name: benzisoxazole_count
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- name: benzoxazole_count
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- name: 2,1-benzisoxazole_count
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- name: naphthalene_count
dtype: int64
- name: 1,2,3,4-tetrahydronaphthalene_count
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- name: octahydronaphthalene_count
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- name: 2H-1-benzopyran_count
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- name: 2H-1-benzopyran-2-one_count
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- name: 4H-1-benzopyran-4-one_count
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- name: 1H-2-benzopyran-1-one_count
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- name: 3H-2-benzopyran-1-one_count
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- name: quinoline_count
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- name: isoquinoline_count
dtype: int64
- name: cinnoline_count
dtype: int64
- name: quinazoline_count
dtype: int64
- name: 1,8-napthyhridine_count
dtype: int64
- name: 1,7-napththyridine_count
dtype: int64
- name: 1,5-napththridine_count
dtype: int64
- name: 1,6-napthyridine_count
dtype: int64
- name: 2H-1,3-benzoxazine_count
dtype: int64
- name: 2H-1,4-benzoxazine_count
dtype: int64
- name: 1H-2,3-benzoxazine_count
dtype: int64
- name: 4H-3,1-benzoxazine_count
dtype: int64
- name: 2H-1,2-benzoxazine_count
dtype: int64
- name: 4H-1,3-benzoxazine_count
dtype: int64
- name: anthracene_count
dtype: int64
- name: phenanthrene_count
dtype: int64
- name: phenalene_count
dtype: int64
- name: fluorene_count
dtype: int64
- name: carbazole_count
dtype: int64
- name: xanthene_count
dtype: int64
- name: acridine_count
dtype: int64
- name: norpinane_count
dtype: int64
- name: 7H-purine_count
dtype: int64
- name: steroid_ring_system_count
dtype: int64
- name: imidazole_count
dtype: int64
- name: thiazol-2-amine_count
dtype: int64
- name: tetrazole_count
dtype: int64
- name: cytosine_count
dtype: int64
- name: adenine_count
dtype: int64
- name: 5-methylindole_count
dtype: int64
- name: isocaffeine_count
dtype: int64
- name: tetrazolethiol_count
dtype: int64
- name: 3-methylisoxazole_count
dtype: int64
- name: 1-methylimidazole_count
dtype: int64
- name: 2-methylimidazole_count
dtype: int64
- name: guanine_count
dtype: int64
- name: tosufloxacin_count
dtype: int64
- name: acetamido_count
dtype: int64
- name: acetoacetyl_count
dtype: int64
- name: acetyl_count
dtype: int64
- name: acryloyl_count
dtype: int64
- name: alanyl_count
dtype: int64
- name: beta-alanyl_count
dtype: int64
- name: allylidene_count
dtype: int64
- name: amidino_count
dtype: int64
- name: amino_count
dtype: int64
- name: amyl_count
dtype: int64
- name: anilino_count
dtype: int64
- name: anisidino_count
dtype: int64
- name: anthranoyl_count
dtype: int64
- name: arsino_count
dtype: int64
- name: azelaoyl_count
dtype: int64
- name: azido_count
dtype: int64
- name: azo_count
dtype: int64
- name: azoxy_count
dtype: int64
- name: benzal_count
dtype: int64
- name: benzamido_count
dtype: int64
- name: benzhydrol_count
dtype: int64
- name: benzoxy_count
dtype: int64
- name: benzoyl_count
dtype: int64
- name: benzylidene_count
dtype: int64
- name: benzylidyne_count
dtype: int64
- name: biphenylyl_count
dtype: int64
- name: biphenylene_count
dtype: int64
- name: butoxy_count
dtype: int64
- name: sec-butoxy_count
dtype: int64
- name: tert-butoxy_count
dtype: int64
- name: butyl_count
dtype: int64
- name: sec-butyl_count
dtype: int64
- name: butyryl_count
dtype: int64
- name: caproyl_count
dtype: int64
- name: capryl_count
dtype: int64
- name: capryloyl_count
dtype: int64
- name: carbamido_count
dtype: int64
- name: carbamoyl_count
dtype: int64
- name: carbamyl_count
dtype: int64
- name: carbazoyl_count
dtype: int64
- name: carbethoxy_count
dtype: int64
- name: carbonyl_count
dtype: int64
- name: carboxy_count
dtype: int64
- name: cetyl_count
dtype: int64
- name: chloroformyl_count
dtype: int64
- name: cinnamoyl_count
dtype: int64
- name: cinnamyl_count
dtype: int64
- name: cinnamylidene_count
dtype: int64
- name: cresyl_count
dtype: int64
- name: crotonoyl_count
dtype: int64
- name: crotyl_count
dtype: int64
- name: cyanamido_count
dtype: int64
- name: cyanato_count
dtype: int64
- name: cyano_count
dtype: int64
- name: decanedioyl_count
dtype: int64
- name: decanoyl_count
dtype: int64
- name: diazo_count
dtype: int64
- name: diazoamino_count
dtype: int64
- name: disilanyl_count
dtype: int64
- name: disiloxanyloxy_count
dtype: int64
- name: disulfinyl_count
dtype: int64
- name: dithio_count
dtype: int64
- name: enanthoyl_count
dtype: int64
- name: epoxy_count
dtype: int64
- name: ethenyl_count
dtype: int64
- name: ethynyl_count
dtype: int64
- name: ethoxy_count
dtype: int64
- name: ethylene_count
dtype: int64
- name: ethylidene_count
dtype: int64
- name: ethylthio_count
dtype: int64
- name: formamido_count
dtype: int64
- name: furmaroyl_count
dtype: int64
- name: furfuryl_count
dtype: int64
- name: furfurylidene_count
dtype: int64
- name: glutamoyl_count
dtype: int64
- name: glutaryl_count
dtype: int64
- name: glycylamino_count
dtype: int64
- name: glycoloyl_count
dtype: int64
- name: glycyl_count
dtype: int64
- name: glyoxyoyl_count
dtype: int64
- name: guanidino_count
dtype: int64
- name: guanyl_count
dtype: int64
- name: heptadecanoyl_count
dtype: int64
- name: heptanamido_count
dtype: int64
- name: heptanoyl_count
dtype: int64
- name: hexadecanoyl_count
dtype: int64
- name: hexamethylene_count
dtype: int64
- name: hexanedioyl_count
dtype: int64
- name: hippuryl_count
dtype: int64
- name: hydrazino_count
dtype: int64
- name: hydrazo_count
dtype: int64
- name: hydrocinnamoyl_count
dtype: int64
- name: hydroperoxy_count
dtype: int64
- name: hydroxyamino_count
dtype: int64
- name: imino_count
dtype: int64
- name: iodoso_count
dtype: int64
- name: iodyl_count
dtype: int64
- name: isoamyl_count
dtype: int64
- name: isobutenyl_count
dtype: int64
- name: isobutoxy_count
dtype: int64
- name: isobutyl_count
dtype: int64
- name: isobutylidene_count
dtype: int64
- name: isobutyryl_count
dtype: int64
- name: isocyanato_count
dtype: int64
- name: isocyano_count
dtype: int64
- name: isohexyl_count
dtype: int64
- name: isoleucyl_count
dtype: int64
- name: isonitroso_count
dtype: int64
- name: isopentyl_count
dtype: int64
- name: isopentylidene_count
dtype: int64
- name: isopropenyl_count
dtype: int64
- name: isopropoxy_count
dtype: int64
- name: isopropyl_count
dtype: int64
- name: isopropylidene_count
dtype: int64
- name: isothiocynato_count
dtype: int64
- name: isovaleryl_count
dtype: int64
- name: lactoyl_count
dtype: int64
- name: lauroyl_count
dtype: int64
- name: lauryl_count
dtype: int64
- name: leucyl_count
dtype: int64
- name: levulinoyl_count
dtype: int64
- name: malonyl_count
dtype: int64
- name: mandeloyl_count
dtype: int64
- name: mercapto_count
dtype: int64
- name: mesityl_count
dtype: int64
- name: methacryloyl_count
dtype: int64
- name: methallyl_count
dtype: int64
- name: methionyl_count
dtype: int64
- name: methoxy_count
dtype: int64
- name: methylene_count
dtype: int64
- name: methylthio_count
dtype: int64
- name: myristoyl_count
dtype: int64
- name: myristyl_count
dtype: int64
- name: naphthyl_count
dtype: int64
- name: naphthylene_count
dtype: int64
- name: neopentyl_count
dtype: int64
- name: nitramino_count
dtype: int64
- name: nitrosamino_count
dtype: int64
- name: nitroso_count
dtype: int64
- name: nonanoyl_count
dtype: int64
- name: oleoyl_count
dtype: int64
- name: oxalyl_count
dtype: int64
- name: oxo_count
dtype: int64
- name: palmitoyl_count
dtype: int64
- name: pentamethylene_count
dtype: int64
- name: pentyl_count
dtype: int64
- name: tert-pentyl_count
dtype: int64
- name: phenacylidene_count
dtype: int64
- name: phenethyl_count
dtype: int64
- name: phenoxy_count
dtype: int64
- name: phenyl_count
dtype: int64
- name: phenylene_count
dtype: int64
- name: phosphino_count
dtype: int64
- name: phosphinyl_count
dtype: int64
- name: phospho_count
dtype: int64
- name: phosphono_count
dtype: int64
- name: phthaloyl_count
dtype: int64
- name: picryl_count
dtype: int64
- name: pimeloyl_count
dtype: int64
- name: piperidino_count
dtype: int64
- name: pivaloyl_count
dtype: int64
- name: prenyl_count
dtype: int64
- name: propargyl_count
dtype: int64
- name: 1-propenyl_count
dtype: int64
- name: 2-propenyl_count
dtype: int64
- name: propionyl_count
dtype: int64
- name: propoxy_count
dtype: int64
- name: propyl_count
dtype: int64
- name: propylidene_count
dtype: int64
- name: pyrryl_count
dtype: int64
- name: salicyloyl_count
dtype: int64
- name: selenyl_count
dtype: int64
- name: seryl_count
dtype: int64
- name: siloxy_count
dtype: int64
- name: silyl_count
dtype: int64
- name: silyene_count
dtype: int64
- name: sorboyl_count
dtype: int64
- name: stearoyl_count
dtype: int64
- name: stearyl_count
dtype: int64
- name: styryl_count
dtype: int64
- name: suberoyl_count
dtype: int64
- name: succinyl_count
dtype: int64
- name: sulfamino_count
dtype: int64
- name: sulfamoyl_count
dtype: int64
- name: sulfanilyl_count
dtype: int64
- name: sulfeno_count
dtype: int64
- name: sulfhydryl_count
dtype: int64
- name: sulfinyl_count
dtype: int64
- name: sulfo_count
dtype: int64
- name: sulfonyl_count
dtype: int64
- name: terephthaloyl_count
dtype: int64
- name: tetramethylene_count
dtype: int64
- name: thienyl_count
dtype: int64
- name: thiocarbonyl_count
dtype: int64
- name: thiocarboxy_count
dtype: int64
- name: thiocyanato_count
dtype: int64
- name: thionyl_count
dtype: int64
- name: threonyl_count
dtype: int64
- name: toluidino_count
dtype: int64
- name: toluoyl_count
dtype: int64
- name: tolyl_count
dtype: int64
- name: alpha-tolyl_count
dtype: int64
- name: tolylene_count
dtype: int64
- name: tosyl_count
dtype: int64
- name: triazano_count
dtype: int64
- name: trimethylene_count
dtype: int64
- name: valeryl_count
dtype: int64
- name: valyl_count
dtype: int64
- name: vinyl_count
dtype: int64
- name: vinylidene_count
dtype: int64
- name: xylidino_count
dtype: int64
- name: xylyl_count
dtype: int64
- name: xylylene_count
dtype: int64
- name: propiolamide_count
dtype: int64
- name: fumarate ester_count
dtype: int64
- name: allenamide_count
dtype: int64
- name: propiolonitrile_count
dtype: int64
- name: propargylamide_count
dtype: int64
- name: arylsulfonyl bicyclobutane_count
dtype: int64
- name: haloalkane_count
dtype: int64
- name: alpha-halomethyl_count
dtype: int64
- name: alpha-haloamide_count
dtype: int64
- name: alpha-haloester_count
dtype: int64
- name: epoxide_count
dtype: int64
- name: aziridine_count
dtype: int64
- name: nitroalkane_count
dtype: int64
- name: acrylamide_count
dtype: int64
- name: cyanoenone_count
dtype: int64
- name: aldehyde_count
dtype: int64
- name: ketone_count
dtype: int64
- name: nitrile_count
dtype: int64
- name: cyanamide_count
dtype: int64
- name: isothicyanate_count
dtype: int64
- name: sulfone_count
dtype: int64
- name: sulfonyl fluoride_count
dtype: int64
- name: sulfonimidoyl fluoride_count
dtype: int64
- name: aryl fluorosulfate_count
dtype: int64
- name: ester_count
dtype: int64
- name: sulfonamide_count
dtype: int64
- name: 2-carbonyl arylboronic acid_count
dtype: int64
- name: n-methyl isoxazolium_count
dtype: int64
- name: oxaziridine_count
dtype: int64
- name: carboxyl_count
dtype: int64
- name: ether_count
dtype: int64
- name: alkanol_count
dtype: int64
- name: thiol_count
dtype: int64
- name: halogen_count
dtype: int64
- name: amine_count
dtype: int64
- name: amide_count
dtype: int64
- name: num_valence_electrons
dtype: int64
- name: rotable_proportion
dtype: float64
- name: non_rotable_proportion
dtype: float64
- name: num_unspecified_bond
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- name: num_single_bonds
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- name: num_double_bonds
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- name: num_triple_bonds
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- name: num_quadruple_bonds
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- name: num_quintuple_bonds
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- name: num_hextuple_bonds
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- name: num_oneandahalf_bonds
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- name: num_twoandahalf_bonds
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- name: num_threeandahalf_bonds
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- name: num_fourandahalf_bonds
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- name: num_fiveandahalf_bonds
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- name: num_aromatic_bonds
dtype: float64
- name: num_ionic_bonds
dtype: float64
- name: num_hydrogen_bonds
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- name: num_threecenter_bonds
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- name: num_dativeone_bonds
dtype: float64
- name: num_dative_bonds
dtype: float64
- name: num_other_bonds
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- name: num_zero_bonds
dtype: float64
- name: num_bonds
dtype: int64
- name: molecular_formula
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- name: carbon_mass
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- name: hydrogen_mass
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- name: nitrogen_mass
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- name: oxygen_mass
dtype: float64
- name: num_carbon_atoms
dtype: int64
- name: num_hydrogen_atoms
dtype: int64
- name: num_nitrogen_atoms
dtype: int64
- name: num_oxygen_atoms
dtype: int64
- name: num_hydrogen_bond_acceptors
dtype: int64
- name: num_hydrogen_bond_donors
dtype: int64
- name: num_lipinski_violations
dtype: int64
- name: inertial_shape_factor
dtype: float64
- name: eccentricity
dtype: float64
- name: asphericity
dtype: float64
- name: npr1_value
dtype: float64
- name: npr2_value
dtype: float64
- name: pmi1_value
dtype: float64
- name: pmi2_value
dtype: float64
- name: pmi3_value
dtype: float64
- name: num_chiral_centers
dtype: int64
- name: representation
dtype: string
splits:
- name: train
num_bytes: 2773167
num_examples: 499
download_size: 518183
dataset_size: 2773167
- config_name: rdkit_feat_6
features:
- name: tert-butyloxycarbonyl_count
dtype: int64
- name: representation_type
dtype: string
- name: trityl_count
dtype: int64
- name: 3,5-dimethoxyphenylisoproxycarbonyl_count
dtype: int64
- name: 2-(4-biphenyl)isopropoxycarbonyl_count
dtype: int64
- name: 2-nitrophenylsulfenyl_count
dtype: int64
- name: boc_count
dtype: int64
- name: trt_count
dtype: int64
- name: ddz_count
dtype: int64
- name: bpoc_count
dtype: int64
- name: nps_count
dtype: int64
- name: 9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: 2-(4-nitrophenylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: (1,1-dioxobenzo[b]thiophene-2-yl)methyloxycarbonyl_count
dtype: int64
- name: (1,1-dioxonaptho[1,2-b]thiophene-2-yl)methyloxycarbonyl_count
dtype: int64
- name: 1-(4,4-dimethyl-2,6-dioxocyclohex-1-ylidene)-3-methylbutyl_count
dtype: int64
- name: 2,7-di-tert-butyl-fmoc_count
dtype: int64
- name: 2-fluoro-fmoc_count
dtype: int64
- name: 2-monoisooctyl-fmoc_count
dtype: int64
- name: 2,7-diisooctyl-fmoc_count
dtype: int64
- name: tetrachlorophthaloyl_count
dtype: int64
- name: 2-[phenyl(methyl)sulfonio])ethyloxycarbonyltetrafluoroborate_count
dtype: int64
- name: ethanesulfonylethoxycarbonyl_count
dtype: int64
- name: 2-(4-sulfophenylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: fmoc_count
dtype: int64
- name: nsc_count
dtype: int64
- name: bsmoc_count
dtype: int64
- name: alpha-nsmoc_count
dtype: int64
- name: ivdde_count
dtype: int64
- name: fmoc*_count
dtype: int64
- name: fmoc(fmoc(2f))_count
dtype: int64
- name: mio-fmoc_count
dtype: int64
- name: dio-fmoc_count
dtype: int64
- name: tcp_count
dtype: int64
- name: pms_count
dtype: int64
- name: esc_count
dtype: int64
- name: sps_count
dtype: int64
- name: benzyloxycarbonyl_count
dtype: int64
- name: allyloxycarbonyl_count
dtype: int64
- name: o-nitrobenzenesulfonyl_count
dtype: int64
- name: 2,4-dinitrobenzenesulfonyl_count
dtype: int64
- name: benzothiazole-2-sulfonyl_count
dtype: int64
- name: 2,2,2-trichloroethyloxycarbonyl_count
dtype: int64
- name: dithiasuccinoyl_count
dtype: int64
- name: p-nitrobenzyloxycarbonyl_count
dtype: int64
- name: alpha-azidoacids_count
dtype: int64
- name: proparglyoxycarbonyl_count
dtype: int64
- name: o-nitrobenzylcarbonyl_count
dtype: int64
- name: 4-nitroveratryloxycarbonyl_count
dtype: int64
- name: 2-(2-nitrophenyl)propyloxycarbonyl_count
dtype: int64
- name: 2-(3,4-methylenedioxy-6-nitrophenyl)propyloxycarbonyl_count
dtype: int64
- name: 9-(4-bromophenyl)-9-fluorenyl_count
dtype: int64
- name: azidomethoxycarbonyl_count
dtype: int64
- name: hexafluoroacetone_count
dtype: int64
- name: Z_count
dtype: int64
- name: alloc_count
dtype: int64
- name: o-nbs_count
dtype: int64
- name: d-nbs_count
dtype: int64
- name: bts_count
dtype: int64
- name: troc_count
dtype: int64
- name: dts_count
dtype: int64
- name: pnz_count
dtype: int64
- name: poc_count
dtype: int64
- name: onz_count
dtype: int64
- name: nvoc_count
dtype: int64
- name: nppoc_count
dtype: int64
- name: mnppoc_count
dtype: int64
- name: brphf_count
dtype: int64
- name: azoc_count
dtype: int64
- name: hfa_count
dtype: int64
- name: 2-chlorobenzyloxycarbonyl_count
dtype: int64
- name: 4-methyltrityl_count
dtype: int64
- name: cl-z_count
dtype: int64
- name: mtt_count
dtype: int64
- name: 1-(4,4-dimethyl-2,6-dioxocylohex-1-ylidene)-3-methylbutyl_count
dtype: int64
- name: trifluoroacetyl_count
dtype: int64
- name: 2-(methylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: tfa_count
dtype: int64
- name: msc_count
dtype: int64
- name: phenyldisulphanylethyloxycarbonyl_count
dtype: int64
- name: 2-pyridyldisulphanylethyloxycarbonyl_count
dtype: int64
- name: phdec_count
dtype: int64
- name: pydec_count
dtype: int64
- name: tert-butyl_count
dtype: int64
- name: 2-chlorotrityl_count
dtype: int64
- name: 2-4-dimethyoxybenzyl_count
dtype: int64
- name: 2-phenylisopropyl_count
dtype: int64
- name: 5-phenyl-3,4-ethylenedioxythenyl_count
dtype: int64
- name: bu_count
dtype: int64
- name: 2-cl-trt_count
dtype: int64
- name: dmb_count
dtype: int64
- name: 2-ph-pr_count
dtype: int64
- name: phenyl-edotn_count
dtype: int64
- name: 9-fluorenylmethyl_count
dtype: int64
- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocylocheylidene)-3-methylbutyl]-amino)benzyl_count
dtype: int64
- name: methyl_count
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- name: ethyl_count
dtype: int64
- name: carbamoylmethyl_count
dtype: int64
- name: fm_count
dtype: int64
- name: dmab_count
dtype: int64
- name: me_count
dtype: int64
- name: et_count
dtype: int64
- name: cam_count
dtype: int64
- name: allyl_count
dtype: int64
- name: benzyl_count
dtype: int64
- name: phenacyl_count
dtype: int64
- name: p-nitrobenzyl_count
dtype: int64
- name: 2-trimethylsilyethyl_count
dtype: int64
- name: (2-phenyl-2-trimethylsilyl)ethyl_count
dtype: int64
- name: 2-(trimethylsilyl)isopropyl_count
dtype: int64
- name: 2,2,2-trichloroethyl_count
dtype: int64
- name: p-hydroxyphenacyl_count
dtype: int64
- name: 4,5-dimethyoxy-2-nitrobenzyl_count
dtype: int64
- name: 1,1-dimethylallyl_count
dtype: int64
- name: pentaaminecobalt_III_count
dtype: int64
- name: al_count
dtype: int64
- name: bn_count
dtype: int64
- name: pac_count
dtype: int64
- name: pnb_count
dtype: int64
- name: tmse_count
dtype: int64
- name: ptmse_count
dtype: int64
- name: tmsi_count
dtype: int64
- name: tce_count
dtype: int64
- name: php_count
dtype: int64
- name: dmnb_count
dtype: int64
- name: dma_count
dtype: int64
- name: cyclohexyl_count
dtype: int64
- name: b-menthyl_count
dtype: int64
- name: b-3-methylpent-3-yl_count
dtype: int64
- name: 4-(3,6,9-trioxadecyl)oxybenzyl_count
dtype: int64
- name: chx_count
dtype: int64
- name: men_count
dtype: int64
- name: mpe_count
dtype: int64
- name: tegbz_count
dtype: int64
- name: 9-fluoroenylmethyl_count
dtype: int64
- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-methyl-butyl]-amino)benzyl_count
dtype: int64
- name: trimethylsilylethyl_count
dtype: int64
- name: 4,5-dimethoxy-2-nitrobenzyloxycarbonyl_count
dtype: int64
- name: pseudoprolines_count
dtype: int64
- name: 2-hydroxy-4-methoxybenzyl_count
dtype: int64
- name: 2,4-dimethoxybenzyl_count
dtype: int64
- name: 2,4,6-trimethoxybenzyl_count
dtype: int64
- name: 1-methyl-3-indolylmethyl_count
dtype: int64
- name: 3,4-ethylene-dioxy-2-thenyl_count
dtype: int64
- name: hmb_count
dtype: int64
- name: tmob_count
dtype: int64
- name: mim_count
dtype: int64
- name: edot_count
dtype: int64
- name: 4-methoxy-2-nitro-benzyl_count
dtype: int64
- name: (6-hydroxy-3-oxido-1,3-benz[d]oxathiol-5-yl)methyl_count
dtype: int64
- name: 2-hydroxy-4-methoxy-5-(methylsulfinyl)benzyl_count
dtype: int64
- name: n-boc-n-methyl[2-(methylamino)ethyl]carbamoyl-hmb_count
dtype: int64
- name: 9-xanthenyl_count
dtype: int64
- name: cyclopropyldimethylcarbinyl_count
dtype: int64
- name: 4,4-dimethoxybenzhydryl_count
dtype: int64
- name: xan_count
dtype: int64
- name: cpd_count
dtype: int64
- name: mbh_count
dtype: int64
- name: p-toluenesulfonyl_count
dtype: int64
- name: 2,2,5,7,8-pentamethylchroman-6-sulfonyl_count
dtype: int64
- name: 2,2,4,6,7-pentamethyl-2,3-dihydrobenzofuran-5-sulfonyl_count
dtype: int64
- name: mesityl-2-sulfonyl_count
dtype: int64
- name: 4-methoxy-2,3,6-trimethylphenylsulfonyl_count
dtype: int64
- name: 1,2-dimethylindole-3-sulfonyl_count
dtype: int64
- name: w,w-bis-tert-butyloxycarbonyl_count
dtype: int64
- name: 5-dibenzosuberenyl_count
dtype: int64
- name: 5-dibenzosuberyl_count
dtype: int64
- name: 2-methoxy-5-dibenzosuberyl_count
dtype: int64
- name: nitro_count
dtype: int64
- name: tos_count
dtype: int64
- name: pmc_count
dtype: int64
- name: pbf_count
dtype: int64
- name: mts_count
dtype: int64
- name: mtr_count
dtype: int64
- name: mis_count
dtype: int64
- name: bis-boc_count
dtype: int64
- name: suben_count
dtype: int64
- name: sub_count
dtype: int64
- name: mesub_count
dtype: int64
- name: no2_count
dtype: int64
- name: w,w-bis-benzyloxycarbonyl_count
dtype: int64
- name: w,w-bis-allyloxycarbonyl_count
dtype: int64
- name: z-small_count
dtype: int64
- name: p-methylbenzyl_count
dtype: int64
- name: p-methoxybenzyl_count
dtype: int64
- name: monomethoxytrityl_count
dtype: int64
- name: trimethoxybenzyl_count
dtype: int64
- name: 2,2,4,6,7-pentamethyl-5-dihydrobenzofuranylmethyl_count
dtype: int64
- name: 1-adamantyl_count
dtype: int64
- name: meb_count
dtype: int64
- name: mob_count
dtype: int64
- name: mmt_count
dtype: int64
- name: pmbf_count
dtype: int64
- name: 1-ada_count
dtype: int64
- name: 2-(2,4-dinitrophenyl)ethyl_count
dtype: int64
- name: 9-fluororenylmethoxycarbonyl_count
dtype: int64
- name: dnpe_count
dtype: int64
- name: acetamidomethyl_count
dtype: int64
- name: phenylacetamidomethyl_count
dtype: int64
- name: 5-tert-butylmercapto_count
dtype: int64
- name: 3-nitro-2-pyridinesulfenyl_count
dtype: int64
- name: 2-pyridinesulfenyl_count
dtype: int64
- name: N-allyloxycarbonyl-N-[2,3,5,6-tetrafluoro-4-(phenylthio)phenyl]]aminomethyl_count
dtype: int64
- name: o-nitrobenzyl_count
dtype: int64
- name: 4-picolyl_count
dtype: int64
- name: ninhydrin_count
dtype: int64
- name: acm_count
dtype: int64
- name: phacm_count
dtype: int64
- name: sbu_count
dtype: int64
- name: npys_count
dtype: int64
- name: s-pyr_count
dtype: int64
- name: fsam_count
dtype: int64
- name: onb_count
dtype: int64
- name: nin_count
dtype: int64
- name: n-tosyl_count
dtype: int64
- name: n-trityl_count
dtype: int64
- name: n-monomethoxytrityl_count
dtype: int64
- name: n-methyltrityl_count
dtype: int64
- name: n-tert-butyloxycarbonyl_count
dtype: int64
- name: n-2,4-dimethylpent-3-yloxycarbonyl_count
dtype: int64
- name: n-benzyloxymethyl_count
dtype: int64
- name: n-tert-butoxymethyl_count
dtype: int64
- name: ntos_count
dtype: int64
- name: ntrt_count
dtype: int64
- name: nmtt_count
dtype: int64
- name: nmmt_count
dtype: int64
- name: nboc_count
dtype: int64
- name: ndoc_count
dtype: int64
- name: nbom_count
dtype: int64
- name: nbum_count
dtype: int64
- name: N-9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: N-2,6-dimethoxybenzoyl_count
dtype: int64
- name: dmbz_count
dtype: int64
- name: N-2,4-dinitrophenyl_count
dtype: int64
- name: dnp_count
dtype: int64
- name: cyclohexyl;_count
dtype: int64
- name: tert-butyldimethylsilyl_count
dtype: int64
- name: tbdms_count
dtype: int64
- name: tert-butyldiphenylsilyl_count
dtype: int64
- name: propargyloxycarbonyl_count
dtype: int64
- name: tbdps_count
dtype: int64
- name: 2,6-dichlorobenzyl_count
dtype: int64
- name: 2-bromobenzyl_count
dtype: int64
- name: 2-bromobenzyloxycarbonyl_count
dtype: int64
- name: 3-pentyl_count
dtype: int64
- name: dcb_count
dtype: int64
- name: brbn_count
dtype: int64
- name: brz_count
dtype: int64
- name: pen_count
dtype: int64
- name: tegb_count
dtype: int64
- name: boc-n-methyl-n-[2-(methylamino)ethyl]carbamoyl_count
dtype: int64
- name: boc-nmec_count
dtype: int64
- name: formyl_count
dtype: int64
- name: cyclohexyloxycarbonyl_count
dtype: int64
- name: for_count
dtype: int64
- name: hoc_count
dtype: int64
- name: cyclopropane_count
dtype: int64
- name: spiropentane_count
dtype: int64
- name: cyclobutane_count
dtype: int64
- name: cyclopentane_count
dtype: int64
- name: furan_count
dtype: int64
- name: thiophene_count
dtype: int64
- name: pyrrole_count
dtype: int64
- name: 2H-pyrrole_count
dtype: int64
- name: 3H-pyrrole_count
dtype: int64
- name: pyrazole_count
dtype: int64
- name: 2H-imidazole_count
dtype: int64
- name: 1,2,3-triazole_count
dtype: int64
- name: 1,2,4-triazole_count
dtype: int64
- name: 1,2-dithiole_count
dtype: int64
- name: 1,3-dithiole_count
dtype: int64
- name: 3H-1,2-oxathiole_count
dtype: int64
- name: isoxazole_count
dtype: int64
- name: oxazole_count
dtype: int64
- name: thiazole_count
dtype: int64
- name: isothiazole_count
dtype: int64
- name: 1,2,3-oxadiazole_count
dtype: int64
- name: 1,2,4-oxadiazole_count
dtype: int64
- name: 1,2,5-oxadiazole_count
dtype: int64
- name: 1,3,4-oxadiazole_count
dtype: int64
- name: 1,2,3,4-oxatriazole_count
dtype: int64
- name: 1,2,3,5-oxatriazole_count
dtype: int64
- name: 3H-1,2,3-dioxazole_count
dtype: int64
- name: 1,2,4-dioxazole_count
dtype: int64
- name: 1,3,2-dioxazole_count
dtype: int64
- name: 1,3,4-dioxazole_count
dtype: int64
- name: 5H-1,2,5-oxathiazole_count
dtype: int64
- name: 1,3-oxathiole_count
dtype: int64
- name: benzene_count
dtype: int64
- name: cyclohexane_count
dtype: int64
- name: 2H-pyran_count
dtype: int64
- name: 4H-pyran_count
dtype: int64
- name: 2H-pyran-2-one_count
dtype: int64
- name: 4H-pyran-4-one_count
dtype: int64
- name: 1,2-dioxin_count
dtype: int64
- name: 1,3-dioxin_count
dtype: int64
- name: pyridine_count
dtype: int64
- name: pyridazine_count
dtype: int64
- name: pyrimidine_count
dtype: int64
- name: pyrazine_count
dtype: int64
- name: piperazine_count
dtype: int64
- name: 1,3,5-triazine_count
dtype: int64
- name: 1,2,4-triazine_count
dtype: int64
- name: 1,2,3-triazine_count
dtype: int64
- name: 4H-1,2-Oxazine_count
dtype: int64
- name: 2H-1,3-Oxazine_count
dtype: int64
- name: 6H-1,3-Oxazine_count
dtype: int64
- name: 6H-1,2-Oxazine_count
dtype: int64
- name: 1,4-Oxazine_count
dtype: int64
- name: 2H-1,2-Oxazine_count
dtype: int64
- name: 4H-1,4-Oxazine_count
dtype: int64
- name: 1,2,5-Oxathiazine_count
dtype: int64
- name: 1,2,6-Oxathiazine_count
dtype: int64
- name: 1,2,4-Oxadiazine_count
dtype: int64
- name: 1,3,5-Oxadiazine_count
dtype: int64
- name: morpholine_count
dtype: int64
- name: azepine_count
dtype: int64
- name: oxepin_count
dtype: int64
- name: thiepin_count
dtype: int64
- name: 4H-1,2-diazepine_count
dtype: int64
- name: indene_count
dtype: int64
- name: 2H-indene_count
dtype: int64
- name: benzofuran_count
dtype: int64
- name: isobenzofuran_count
dtype: int64
- name: benzo[b]thiophene_count
dtype: int64
- name: benzo[c]thiophene_count
dtype: int64
- name: indole_count
dtype: int64
- name: 3H-indole_count
dtype: int64
- name: 1H-indole_count
dtype: int64
- name: cyclopenta[b]pyridine_count
dtype: int64
- name: pyrano[3,4-b]-pyrrole_count
dtype: int64
- name: indazole_count
dtype: int64
- name: benzisoxazole_count
dtype: int64
- name: benzoxazole_count
dtype: int64
- name: 2,1-benzisoxazole_count
dtype: int64
- name: naphthalene_count
dtype: int64
- name: 1,2,3,4-tetrahydronaphthalene_count
dtype: int64
- name: octahydronaphthalene_count
dtype: int64
- name: 2H-1-benzopyran_count
dtype: int64
- name: 2H-1-benzopyran-2-one_count
dtype: int64
- name: 4H-1-benzopyran-4-one_count
dtype: int64
- name: 1H-2-benzopyran-1-one_count
dtype: int64
- name: 3H-2-benzopyran-1-one_count
dtype: int64
- name: quinoline_count
dtype: int64
- name: isoquinoline_count
dtype: int64
- name: cinnoline_count
dtype: int64
- name: quinazoline_count
dtype: int64
- name: 1,8-napthyhridine_count
dtype: int64
- name: 1,7-napththyridine_count
dtype: int64
- name: 1,5-napththridine_count
dtype: int64
- name: 1,6-napthyridine_count
dtype: int64
- name: 2H-1,3-benzoxazine_count
dtype: int64
- name: 2H-1,4-benzoxazine_count
dtype: int64
- name: 1H-2,3-benzoxazine_count
dtype: int64
- name: 4H-3,1-benzoxazine_count
dtype: int64
- name: 2H-1,2-benzoxazine_count
dtype: int64
- name: 4H-1,3-benzoxazine_count
dtype: int64
- name: anthracene_count
dtype: int64
- name: phenanthrene_count
dtype: int64
- name: phenalene_count
dtype: int64
- name: fluorene_count
dtype: int64
- name: carbazole_count
dtype: int64
- name: xanthene_count
dtype: int64
- name: acridine_count
dtype: int64
- name: norpinane_count
dtype: int64
- name: 7H-purine_count
dtype: int64
- name: steroid_ring_system_count
dtype: int64
- name: imidazole_count
dtype: int64
- name: thiazol-2-amine_count
dtype: int64
- name: tetrazole_count
dtype: int64
- name: cytosine_count
dtype: int64
- name: adenine_count
dtype: int64
- name: 5-methylindole_count
dtype: int64
- name: isocaffeine_count
dtype: int64
- name: tetrazolethiol_count
dtype: int64
- name: 3-methylisoxazole_count
dtype: int64
- name: 1-methylimidazole_count
dtype: int64
- name: 2-methylimidazole_count
dtype: int64
- name: guanine_count
dtype: int64
- name: tosufloxacin_count
dtype: int64
- name: acetamido_count
dtype: int64
- name: acetoacetyl_count
dtype: int64
- name: acetyl_count
dtype: int64
- name: acryloyl_count
dtype: int64
- name: alanyl_count
dtype: int64
- name: beta-alanyl_count
dtype: int64
- name: allylidene_count
dtype: int64
- name: amidino_count
dtype: int64
- name: amino_count
dtype: int64
- name: amyl_count
dtype: int64
- name: anilino_count
dtype: int64
- name: anisidino_count
dtype: int64
- name: anthranoyl_count
dtype: int64
- name: arsino_count
dtype: int64
- name: azelaoyl_count
dtype: int64
- name: azido_count
dtype: int64
- name: azo_count
dtype: int64
- name: azoxy_count
dtype: int64
- name: benzal_count
dtype: int64
- name: benzamido_count
dtype: int64
- name: benzhydrol_count
dtype: int64
- name: benzoxy_count
dtype: int64
- name: benzoyl_count
dtype: int64
- name: benzylidene_count
dtype: int64
- name: benzylidyne_count
dtype: int64
- name: biphenylyl_count
dtype: int64
- name: biphenylene_count
dtype: int64
- name: butoxy_count
dtype: int64
- name: sec-butoxy_count
dtype: int64
- name: tert-butoxy_count
dtype: int64
- name: butyl_count
dtype: int64
- name: sec-butyl_count
dtype: int64
- name: butyryl_count
dtype: int64
- name: caproyl_count
dtype: int64
- name: capryl_count
dtype: int64
- name: capryloyl_count
dtype: int64
- name: carbamido_count
dtype: int64
- name: carbamoyl_count
dtype: int64
- name: carbamyl_count
dtype: int64
- name: carbazoyl_count
dtype: int64
- name: carbethoxy_count
dtype: int64
- name: carbonyl_count
dtype: int64
- name: carboxy_count
dtype: int64
- name: cetyl_count
dtype: int64
- name: chloroformyl_count
dtype: int64
- name: cinnamoyl_count
dtype: int64
- name: cinnamyl_count
dtype: int64
- name: cinnamylidene_count
dtype: int64
- name: cresyl_count
dtype: int64
- name: crotonoyl_count
dtype: int64
- name: crotyl_count
dtype: int64
- name: cyanamido_count
dtype: int64
- name: cyanato_count
dtype: int64
- name: cyano_count
dtype: int64
- name: decanedioyl_count
dtype: int64
- name: decanoyl_count
dtype: int64
- name: diazo_count
dtype: int64
- name: diazoamino_count
dtype: int64
- name: disilanyl_count
dtype: int64
- name: disiloxanyloxy_count
dtype: int64
- name: disulfinyl_count
dtype: int64
- name: dithio_count
dtype: int64
- name: enanthoyl_count
dtype: int64
- name: epoxy_count
dtype: int64
- name: ethenyl_count
dtype: int64
- name: ethynyl_count
dtype: int64
- name: ethoxy_count
dtype: int64
- name: ethylene_count
dtype: int64
- name: ethylidene_count
dtype: int64
- name: ethylthio_count
dtype: int64
- name: formamido_count
dtype: int64
- name: furmaroyl_count
dtype: int64
- name: furfuryl_count
dtype: int64
- name: furfurylidene_count
dtype: int64
- name: glutamoyl_count
dtype: int64
- name: glutaryl_count
dtype: int64
- name: glycylamino_count
dtype: int64
- name: glycoloyl_count
dtype: int64
- name: glycyl_count
dtype: int64
- name: glyoxyoyl_count
dtype: int64
- name: guanidino_count
dtype: int64
- name: guanyl_count
dtype: int64
- name: heptadecanoyl_count
dtype: int64
- name: heptanamido_count
dtype: int64
- name: heptanoyl_count
dtype: int64
- name: hexadecanoyl_count
dtype: int64
- name: hexamethylene_count
dtype: int64
- name: hexanedioyl_count
dtype: int64
- name: hippuryl_count
dtype: int64
- name: hydrazino_count
dtype: int64
- name: hydrazo_count
dtype: int64
- name: hydrocinnamoyl_count
dtype: int64
- name: hydroperoxy_count
dtype: int64
- name: hydroxyamino_count
dtype: int64
- name: imino_count
dtype: int64
- name: iodoso_count
dtype: int64
- name: iodyl_count
dtype: int64
- name: isoamyl_count
dtype: int64
- name: isobutenyl_count
dtype: int64
- name: isobutoxy_count
dtype: int64
- name: isobutyl_count
dtype: int64
- name: isobutylidene_count
dtype: int64
- name: isobutyryl_count
dtype: int64
- name: isocyanato_count
dtype: int64
- name: isocyano_count
dtype: int64
- name: isohexyl_count
dtype: int64
- name: isoleucyl_count
dtype: int64
- name: isonitroso_count
dtype: int64
- name: isopentyl_count
dtype: int64
- name: isopentylidene_count
dtype: int64
- name: isopropenyl_count
dtype: int64
- name: isopropoxy_count
dtype: int64
- name: isopropyl_count
dtype: int64
- name: isopropylidene_count
dtype: int64
- name: isothiocynato_count
dtype: int64
- name: isovaleryl_count
dtype: int64
- name: lactoyl_count
dtype: int64
- name: lauroyl_count
dtype: int64
- name: lauryl_count
dtype: int64
- name: leucyl_count
dtype: int64
- name: levulinoyl_count
dtype: int64
- name: malonyl_count
dtype: int64
- name: mandeloyl_count
dtype: int64
- name: mercapto_count
dtype: int64
- name: mesityl_count
dtype: int64
- name: methacryloyl_count
dtype: int64
- name: methallyl_count
dtype: int64
- name: methionyl_count
dtype: int64
- name: methoxy_count
dtype: int64
- name: methylene_count
dtype: int64
- name: methylthio_count
dtype: int64
- name: myristoyl_count
dtype: int64
- name: myristyl_count
dtype: int64
- name: naphthyl_count
dtype: int64
- name: naphthylene_count
dtype: int64
- name: neopentyl_count
dtype: int64
- name: nitramino_count
dtype: int64
- name: nitrosamino_count
dtype: int64
- name: nitroso_count
dtype: int64
- name: nonanoyl_count
dtype: int64
- name: oleoyl_count
dtype: int64
- name: oxalyl_count
dtype: int64
- name: oxo_count
dtype: int64
- name: palmitoyl_count
dtype: int64
- name: pentamethylene_count
dtype: int64
- name: pentyl_count
dtype: int64
- name: tert-pentyl_count
dtype: int64
- name: phenacylidene_count
dtype: int64
- name: phenethyl_count
dtype: int64
- name: phenoxy_count
dtype: int64
- name: phenyl_count
dtype: int64
- name: phenylene_count
dtype: int64
- name: phosphino_count
dtype: int64
- name: phosphinyl_count
dtype: int64
- name: phospho_count
dtype: int64
- name: phosphono_count
dtype: int64
- name: phthaloyl_count
dtype: int64
- name: picryl_count
dtype: int64
- name: pimeloyl_count
dtype: int64
- name: piperidino_count
dtype: int64
- name: pivaloyl_count
dtype: int64
- name: prenyl_count
dtype: int64
- name: propargyl_count
dtype: int64
- name: 1-propenyl_count
dtype: int64
- name: 2-propenyl_count
dtype: int64
- name: propionyl_count
dtype: int64
- name: propoxy_count
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- name: propyl_count
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- name: propylidene_count
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- name: pyrryl_count
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- name: salicyloyl_count
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- name: selenyl_count
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- name: seryl_count
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- name: siloxy_count
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- name: silyl_count
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- name: silyene_count
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- name: sorboyl_count
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- name: stearoyl_count
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- name: stearyl_count
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- name: styryl_count
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- name: suberoyl_count
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- name: succinyl_count
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- name: sulfamino_count
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- name: sulfamoyl_count
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- name: sulfanilyl_count
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- name: sulfeno_count
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- name: sulfhydryl_count
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- name: sulfinyl_count
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- name: sulfo_count
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- name: sulfonyl_count
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- name: terephthaloyl_count
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- name: tetramethylene_count
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- name: thienyl_count
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- name: thiocarbonyl_count
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- name: thiocarboxy_count
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- name: thiocyanato_count
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- name: thionyl_count
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- name: threonyl_count
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- name: toluidino_count
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- name: toluoyl_count
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- name: tolyl_count
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- name: alpha-tolyl_count
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- name: tolylene_count
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- name: tosyl_count
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- name: triazano_count
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- name: trimethylene_count
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- name: valeryl_count
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- name: valyl_count
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- name: vinyl_count
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- name: vinylidene_count
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- name: xylidino_count
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- name: xylyl_count
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- name: xylylene_count
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- name: propiolamide_count
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- name: fumarate ester_count
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- name: allenamide_count
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- name: propiolonitrile_count
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- name: propargylamide_count
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- name: arylsulfonyl bicyclobutane_count
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- name: haloalkane_count
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- name: alpha-halomethyl_count
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- name: alpha-haloamide_count
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- name: alpha-haloester_count
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- name: epoxide_count
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- name: aziridine_count
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- name: nitroalkane_count
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- name: acrylamide_count
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- name: cyanoenone_count
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- name: aldehyde_count
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- name: ketone_count
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- name: nitrile_count
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- name: cyanamide_count
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- name: isothicyanate_count
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- name: sulfone_count
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- name: sulfonyl fluoride_count
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- name: sulfonimidoyl fluoride_count
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- name: aryl fluorosulfate_count
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- name: ester_count
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- name: n-methyl isoxazolium_count
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- name: ether_count
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- name: thiol_count
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- name: halogen_count
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- name: amine_count
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- name: amide_count
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- name: num_valence_electrons
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- name: rotable_proportion
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- name: non_rotable_proportion
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- name: num_unspecified_bond
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- name: num_aromatic_bonds
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- name: num_ionic_bonds
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- name: num_hydrogen_bonds
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- name: num_dativeone_bonds
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- name: num_dative_bonds
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- name: oxygen_mass
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- name: num_hydrogen_atoms
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- name: num_nitrogen_atoms
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- name: num_oxygen_atoms
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- name: num_hydrogen_bond_acceptors
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- name: num_hydrogen_bond_donors
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- name: num_lipinski_violations
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- name: inertial_shape_factor
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- name: eccentricity
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- name: asphericity
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- name: npr1_value
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- name: npr2_value
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- name: pmi1_value
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- name: pmi2_value
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- name: pmi3_value
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- name: num_chiral_centers
dtype: int64
- name: representation
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splits:
- name: train
num_bytes: 2760435
num_examples: 499
download_size: 521279
dataset_size: 2760435
- config_name: rdkit_feat_7
features:
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dtype: int64
- name: representation_type
dtype: string
- name: trityl_count
dtype: int64
- name: 3,5-dimethoxyphenylisoproxycarbonyl_count
dtype: int64
- name: 2-(4-biphenyl)isopropoxycarbonyl_count
dtype: int64
- name: 2-nitrophenylsulfenyl_count
dtype: int64
- name: boc_count
dtype: int64
- name: trt_count
dtype: int64
- name: ddz_count
dtype: int64
- name: bpoc_count
dtype: int64
- name: nps_count
dtype: int64
- name: 9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: 2-(4-nitrophenylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: (1,1-dioxobenzo[b]thiophene-2-yl)methyloxycarbonyl_count
dtype: int64
- name: (1,1-dioxonaptho[1,2-b]thiophene-2-yl)methyloxycarbonyl_count
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- name: 1-(4,4-dimethyl-2,6-dioxocyclohex-1-ylidene)-3-methylbutyl_count
dtype: int64
- name: 2,7-di-tert-butyl-fmoc_count
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- name: 2-fluoro-fmoc_count
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- name: 2-monoisooctyl-fmoc_count
dtype: int64
- name: 2,7-diisooctyl-fmoc_count
dtype: int64
- name: tetrachlorophthaloyl_count
dtype: int64
- name: 2-[phenyl(methyl)sulfonio])ethyloxycarbonyltetrafluoroborate_count
dtype: int64
- name: ethanesulfonylethoxycarbonyl_count
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- name: 2-(4-sulfophenylsulfonyl)ethoxycarbonyl_count
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- name: fmoc_count
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- name: nsc_count
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- name: bsmoc_count
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- name: alpha-nsmoc_count
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- name: ivdde_count
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- name: fmoc*_count
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- name: fmoc(fmoc(2f))_count
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- name: mio-fmoc_count
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- name: dio-fmoc_count
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- name: tcp_count
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- name: pms_count
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- name: esc_count
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- name: sps_count
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- name: benzyloxycarbonyl_count
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- name: allyloxycarbonyl_count
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- name: o-nitrobenzenesulfonyl_count
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- name: 2,4-dinitrobenzenesulfonyl_count
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- name: benzothiazole-2-sulfonyl_count
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- name: 2,2,2-trichloroethyloxycarbonyl_count
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- name: dithiasuccinoyl_count
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- name: p-nitrobenzyloxycarbonyl_count
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- name: alpha-azidoacids_count
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- name: proparglyoxycarbonyl_count
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- name: o-nitrobenzylcarbonyl_count
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- name: 4-nitroveratryloxycarbonyl_count
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- name: 2-(2-nitrophenyl)propyloxycarbonyl_count
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- name: 2-(3,4-methylenedioxy-6-nitrophenyl)propyloxycarbonyl_count
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- name: 9-(4-bromophenyl)-9-fluorenyl_count
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- name: azidomethoxycarbonyl_count
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- name: hexafluoroacetone_count
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- name: Z_count
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- name: alloc_count
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- name: o-nbs_count
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- name: d-nbs_count
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- name: bts_count
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- name: troc_count
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- name: dts_count
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- name: pnz_count
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- name: poc_count
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- name: onz_count
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- name: nvoc_count
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- name: nppoc_count
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- name: mnppoc_count
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- name: brphf_count
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- name: azoc_count
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- name: hfa_count
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- name: 2-chlorobenzyloxycarbonyl_count
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- name: 4-methyltrityl_count
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- name: trifluoroacetyl_count
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- name: pydec_count
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- name: tert-butyl_count
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- name: 2-chlorotrityl_count
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- name: 2-4-dimethyoxybenzyl_count
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- name: 2-phenylisopropyl_count
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- name: 5-phenyl-3,4-ethylenedioxythenyl_count
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- name: bu_count
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- name: 2-cl-trt_count
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- name: dmb_count
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- name: 2-ph-pr_count
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- name: phenyl-edotn_count
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- name: 9-fluorenylmethyl_count
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- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocylocheylidene)-3-methylbutyl]-amino)benzyl_count
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- name: methyl_count
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- name: ethyl_count
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- name: carbamoylmethyl_count
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- name: fm_count
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- name: dmab_count
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- name: me_count
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- name: et_count
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- name: cam_count
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- name: allyl_count
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- name: benzyl_count
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- name: phenacyl_count
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- name: p-nitrobenzyl_count
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- name: 2-trimethylsilyethyl_count
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- name: 2-(trimethylsilyl)isopropyl_count
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- name: pnb_count
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- name: ptmse_count
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- name: tmsi_count
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- name: tce_count
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- name: php_count
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- name: dmnb_count
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- name: dma_count
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- name: cyclohexyl_count
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- name: b-menthyl_count
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- name: b-3-methylpent-3-yl_count
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- name: 4-(3,6,9-trioxadecyl)oxybenzyl_count
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- name: men_count
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- name: tegbz_count
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- name: 9-fluoroenylmethyl_count
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- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-methyl-butyl]-amino)benzyl_count
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- name: 4,5-dimethoxy-2-nitrobenzyloxycarbonyl_count
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- name: 2,4-dimethoxybenzyl_count
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- name: tmob_count
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- name: mim_count
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- name: 2,2,4,6,7-pentamethyl-2,3-dihydrobenzofuran-5-sulfonyl_count
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- name: 1,2-dimethylindole-3-sulfonyl_count
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- name: w,w-bis-tert-butyloxycarbonyl_count
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- name: 5-dibenzosuberenyl_count
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- name: 5-dibenzosuberyl_count
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- name: 2-methoxy-5-dibenzosuberyl_count
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- name: mts_count
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- name: mis_count
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- name: suben_count
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- name: sub_count
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- name: mesub_count
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- name: no2_count
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- name: w,w-bis-benzyloxycarbonyl_count
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- name: mmt_count
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- name: phenylacetamidomethyl_count
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- name: 5-tert-butylmercapto_count
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- name: 3-nitro-2-pyridinesulfenyl_count
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- name: 2-pyridinesulfenyl_count
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- name: ninhydrin_count
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- name: acm_count
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- name: phacm_count
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- name: sbu_count
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- name: npys_count
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- name: s-pyr_count
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- name: fsam_count
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- name: onb_count
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- name: nin_count
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- name: n-tosyl_count
dtype: int64
- name: n-trityl_count
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- name: n-monomethoxytrityl_count
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- name: n-methyltrityl_count
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- name: n-tert-butyloxycarbonyl_count
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- name: n-2,4-dimethylpent-3-yloxycarbonyl_count
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- name: n-benzyloxymethyl_count
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- name: n-tert-butoxymethyl_count
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- name: ntos_count
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- name: ntrt_count
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- name: nmtt_count
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- name: nmmt_count
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- name: nboc_count
dtype: int64
- name: ndoc_count
dtype: int64
- name: nbom_count
dtype: int64
- name: nbum_count
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- name: N-9-fluorenylmethoxycarbonyl_count
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- name: N-2,6-dimethoxybenzoyl_count
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- name: dmbz_count
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- name: cyclohexyl;_count
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- name: tert-butyldimethylsilyl_count
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- name: tbdms_count
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- name: tert-butyldiphenylsilyl_count
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- name: propargyloxycarbonyl_count
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- name: tbdps_count
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- name: 2,6-dichlorobenzyl_count
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- name: 2-bromobenzyl_count
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- name: 2-bromobenzyloxycarbonyl_count
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- name: 3-pentyl_count
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- name: dcb_count
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- name: brbn_count
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- name: brz_count
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- name: pen_count
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- name: tegb_count
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- name: boc-n-methyl-n-[2-(methylamino)ethyl]carbamoyl_count
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- name: cyclohexyloxycarbonyl_count
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- name: for_count
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- name: hoc_count
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- name: cyclopropane_count
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- name: spiropentane_count
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- name: cyclobutane_count
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- name: cyclopentane_count
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- name: furan_count
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- name: thiophene_count
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- name: pyrrole_count
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- name: 2H-pyrrole_count
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- name: 3H-pyrrole_count
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- name: isoxazole_count
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- name: isothiazole_count
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- name: 1,2,3-oxadiazole_count
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- name: 1,2,3,4-oxatriazole_count
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- name: 1,2,3,5-oxatriazole_count
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- name: 3H-1,2,3-dioxazole_count
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- name: 1,2,4-dioxazole_count
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- name: 1,3,2-dioxazole_count
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- name: 1,3,4-dioxazole_count
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- name: 5H-1,2,5-oxathiazole_count
dtype: int64
- name: 1,3-oxathiole_count
dtype: int64
- name: benzene_count
dtype: int64
- name: cyclohexane_count
dtype: int64
- name: 2H-pyran_count
dtype: int64
- name: 4H-pyran_count
dtype: int64
- name: 2H-pyran-2-one_count
dtype: int64
- name: 4H-pyran-4-one_count
dtype: int64
- name: 1,2-dioxin_count
dtype: int64
- name: 1,3-dioxin_count
dtype: int64
- name: pyridine_count
dtype: int64
- name: pyridazine_count
dtype: int64
- name: pyrimidine_count
dtype: int64
- name: pyrazine_count
dtype: int64
- name: piperazine_count
dtype: int64
- name: 1,3,5-triazine_count
dtype: int64
- name: 1,2,4-triazine_count
dtype: int64
- name: 1,2,3-triazine_count
dtype: int64
- name: 4H-1,2-Oxazine_count
dtype: int64
- name: 2H-1,3-Oxazine_count
dtype: int64
- name: 6H-1,3-Oxazine_count
dtype: int64
- name: 6H-1,2-Oxazine_count
dtype: int64
- name: 1,4-Oxazine_count
dtype: int64
- name: 2H-1,2-Oxazine_count
dtype: int64
- name: 4H-1,4-Oxazine_count
dtype: int64
- name: 1,2,5-Oxathiazine_count
dtype: int64
- name: 1,2,6-Oxathiazine_count
dtype: int64
- name: 1,2,4-Oxadiazine_count
dtype: int64
- name: 1,3,5-Oxadiazine_count
dtype: int64
- name: morpholine_count
dtype: int64
- name: azepine_count
dtype: int64
- name: oxepin_count
dtype: int64
- name: thiepin_count
dtype: int64
- name: 4H-1,2-diazepine_count
dtype: int64
- name: indene_count
dtype: int64
- name: 2H-indene_count
dtype: int64
- name: benzofuran_count
dtype: int64
- name: isobenzofuran_count
dtype: int64
- name: benzo[b]thiophene_count
dtype: int64
- name: benzo[c]thiophene_count
dtype: int64
- name: indole_count
dtype: int64
- name: 3H-indole_count
dtype: int64
- name: 1H-indole_count
dtype: int64
- name: cyclopenta[b]pyridine_count
dtype: int64
- name: pyrano[3,4-b]-pyrrole_count
dtype: int64
- name: indazole_count
dtype: int64
- name: benzisoxazole_count
dtype: int64
- name: benzoxazole_count
dtype: int64
- name: 2,1-benzisoxazole_count
dtype: int64
- name: naphthalene_count
dtype: int64
- name: 1,2,3,4-tetrahydronaphthalene_count
dtype: int64
- name: octahydronaphthalene_count
dtype: int64
- name: 2H-1-benzopyran_count
dtype: int64
- name: 2H-1-benzopyran-2-one_count
dtype: int64
- name: 4H-1-benzopyran-4-one_count
dtype: int64
- name: 1H-2-benzopyran-1-one_count
dtype: int64
- name: 3H-2-benzopyran-1-one_count
dtype: int64
- name: quinoline_count
dtype: int64
- name: isoquinoline_count
dtype: int64
- name: cinnoline_count
dtype: int64
- name: quinazoline_count
dtype: int64
- name: 1,8-napthyhridine_count
dtype: int64
- name: 1,7-napththyridine_count
dtype: int64
- name: 1,5-napththridine_count
dtype: int64
- name: 1,6-napthyridine_count
dtype: int64
- name: 2H-1,3-benzoxazine_count
dtype: int64
- name: 2H-1,4-benzoxazine_count
dtype: int64
- name: 1H-2,3-benzoxazine_count
dtype: int64
- name: 4H-3,1-benzoxazine_count
dtype: int64
- name: 2H-1,2-benzoxazine_count
dtype: int64
- name: 4H-1,3-benzoxazine_count
dtype: int64
- name: anthracene_count
dtype: int64
- name: phenanthrene_count
dtype: int64
- name: phenalene_count
dtype: int64
- name: fluorene_count
dtype: int64
- name: carbazole_count
dtype: int64
- name: xanthene_count
dtype: int64
- name: acridine_count
dtype: int64
- name: norpinane_count
dtype: int64
- name: 7H-purine_count
dtype: int64
- name: steroid_ring_system_count
dtype: int64
- name: imidazole_count
dtype: int64
- name: thiazol-2-amine_count
dtype: int64
- name: tetrazole_count
dtype: int64
- name: cytosine_count
dtype: int64
- name: adenine_count
dtype: int64
- name: 5-methylindole_count
dtype: int64
- name: isocaffeine_count
dtype: int64
- name: tetrazolethiol_count
dtype: int64
- name: 3-methylisoxazole_count
dtype: int64
- name: 1-methylimidazole_count
dtype: int64
- name: 2-methylimidazole_count
dtype: int64
- name: guanine_count
dtype: int64
- name: tosufloxacin_count
dtype: int64
- name: acetamido_count
dtype: int64
- name: acetoacetyl_count
dtype: int64
- name: acetyl_count
dtype: int64
- name: acryloyl_count
dtype: int64
- name: alanyl_count
dtype: int64
- name: beta-alanyl_count
dtype: int64
- name: allylidene_count
dtype: int64
- name: amidino_count
dtype: int64
- name: amino_count
dtype: int64
- name: amyl_count
dtype: int64
- name: anilino_count
dtype: int64
- name: anisidino_count
dtype: int64
- name: anthranoyl_count
dtype: int64
- name: arsino_count
dtype: int64
- name: azelaoyl_count
dtype: int64
- name: azido_count
dtype: int64
- name: azo_count
dtype: int64
- name: azoxy_count
dtype: int64
- name: benzal_count
dtype: int64
- name: benzamido_count
dtype: int64
- name: benzhydrol_count
dtype: int64
- name: benzoxy_count
dtype: int64
- name: benzoyl_count
dtype: int64
- name: benzylidene_count
dtype: int64
- name: benzylidyne_count
dtype: int64
- name: biphenylyl_count
dtype: int64
- name: biphenylene_count
dtype: int64
- name: butoxy_count
dtype: int64
- name: sec-butoxy_count
dtype: int64
- name: tert-butoxy_count
dtype: int64
- name: butyl_count
dtype: int64
- name: sec-butyl_count
dtype: int64
- name: butyryl_count
dtype: int64
- name: caproyl_count
dtype: int64
- name: capryl_count
dtype: int64
- name: capryloyl_count
dtype: int64
- name: carbamido_count
dtype: int64
- name: carbamoyl_count
dtype: int64
- name: carbamyl_count
dtype: int64
- name: carbazoyl_count
dtype: int64
- name: carbethoxy_count
dtype: int64
- name: carbonyl_count
dtype: int64
- name: carboxy_count
dtype: int64
- name: cetyl_count
dtype: int64
- name: chloroformyl_count
dtype: int64
- name: cinnamoyl_count
dtype: int64
- name: cinnamyl_count
dtype: int64
- name: cinnamylidene_count
dtype: int64
- name: cresyl_count
dtype: int64
- name: crotonoyl_count
dtype: int64
- name: crotyl_count
dtype: int64
- name: cyanamido_count
dtype: int64
- name: cyanato_count
dtype: int64
- name: cyano_count
dtype: int64
- name: decanedioyl_count
dtype: int64
- name: decanoyl_count
dtype: int64
- name: diazo_count
dtype: int64
- name: diazoamino_count
dtype: int64
- name: disilanyl_count
dtype: int64
- name: disiloxanyloxy_count
dtype: int64
- name: disulfinyl_count
dtype: int64
- name: dithio_count
dtype: int64
- name: enanthoyl_count
dtype: int64
- name: epoxy_count
dtype: int64
- name: ethenyl_count
dtype: int64
- name: ethynyl_count
dtype: int64
- name: ethoxy_count
dtype: int64
- name: ethylene_count
dtype: int64
- name: ethylidene_count
dtype: int64
- name: ethylthio_count
dtype: int64
- name: formamido_count
dtype: int64
- name: furmaroyl_count
dtype: int64
- name: furfuryl_count
dtype: int64
- name: furfurylidene_count
dtype: int64
- name: glutamoyl_count
dtype: int64
- name: glutaryl_count
dtype: int64
- name: glycylamino_count
dtype: int64
- name: glycoloyl_count
dtype: int64
- name: glycyl_count
dtype: int64
- name: glyoxyoyl_count
dtype: int64
- name: guanidino_count
dtype: int64
- name: guanyl_count
dtype: int64
- name: heptadecanoyl_count
dtype: int64
- name: heptanamido_count
dtype: int64
- name: heptanoyl_count
dtype: int64
- name: hexadecanoyl_count
dtype: int64
- name: hexamethylene_count
dtype: int64
- name: hexanedioyl_count
dtype: int64
- name: hippuryl_count
dtype: int64
- name: hydrazino_count
dtype: int64
- name: hydrazo_count
dtype: int64
- name: hydrocinnamoyl_count
dtype: int64
- name: hydroperoxy_count
dtype: int64
- name: hydroxyamino_count
dtype: int64
- name: imino_count
dtype: int64
- name: iodoso_count
dtype: int64
- name: iodyl_count
dtype: int64
- name: isoamyl_count
dtype: int64
- name: isobutenyl_count
dtype: int64
- name: isobutoxy_count
dtype: int64
- name: isobutyl_count
dtype: int64
- name: isobutylidene_count
dtype: int64
- name: isobutyryl_count
dtype: int64
- name: isocyanato_count
dtype: int64
- name: isocyano_count
dtype: int64
- name: isohexyl_count
dtype: int64
- name: isoleucyl_count
dtype: int64
- name: isonitroso_count
dtype: int64
- name: isopentyl_count
dtype: int64
- name: isopentylidene_count
dtype: int64
- name: isopropenyl_count
dtype: int64
- name: isopropoxy_count
dtype: int64
- name: isopropyl_count
dtype: int64
- name: isopropylidene_count
dtype: int64
- name: isothiocynato_count
dtype: int64
- name: isovaleryl_count
dtype: int64
- name: lactoyl_count
dtype: int64
- name: lauroyl_count
dtype: int64
- name: lauryl_count
dtype: int64
- name: leucyl_count
dtype: int64
- name: levulinoyl_count
dtype: int64
- name: malonyl_count
dtype: int64
- name: mandeloyl_count
dtype: int64
- name: mercapto_count
dtype: int64
- name: mesityl_count
dtype: int64
- name: methacryloyl_count
dtype: int64
- name: methallyl_count
dtype: int64
- name: methionyl_count
dtype: int64
- name: methoxy_count
dtype: int64
- name: methylene_count
dtype: int64
- name: methylthio_count
dtype: int64
- name: myristoyl_count
dtype: int64
- name: myristyl_count
dtype: int64
- name: naphthyl_count
dtype: int64
- name: naphthylene_count
dtype: int64
- name: neopentyl_count
dtype: int64
- name: nitramino_count
dtype: int64
- name: nitrosamino_count
dtype: int64
- name: nitroso_count
dtype: int64
- name: nonanoyl_count
dtype: int64
- name: oleoyl_count
dtype: int64
- name: oxalyl_count
dtype: int64
- name: oxo_count
dtype: int64
- name: palmitoyl_count
dtype: int64
- name: pentamethylene_count
dtype: int64
- name: pentyl_count
dtype: int64
- name: tert-pentyl_count
dtype: int64
- name: phenacylidene_count
dtype: int64
- name: phenethyl_count
dtype: int64
- name: phenoxy_count
dtype: int64
- name: phenyl_count
dtype: int64
- name: phenylene_count
dtype: int64
- name: phosphino_count
dtype: int64
- name: phosphinyl_count
dtype: int64
- name: phospho_count
dtype: int64
- name: phosphono_count
dtype: int64
- name: phthaloyl_count
dtype: int64
- name: picryl_count
dtype: int64
- name: pimeloyl_count
dtype: int64
- name: piperidino_count
dtype: int64
- name: pivaloyl_count
dtype: int64
- name: prenyl_count
dtype: int64
- name: propargyl_count
dtype: int64
- name: 1-propenyl_count
dtype: int64
- name: 2-propenyl_count
dtype: int64
- name: propionyl_count
dtype: int64
- name: propoxy_count
dtype: int64
- name: propyl_count
dtype: int64
- name: propylidene_count
dtype: int64
- name: pyrryl_count
dtype: int64
- name: salicyloyl_count
dtype: int64
- name: selenyl_count
dtype: int64
- name: seryl_count
dtype: int64
- name: siloxy_count
dtype: int64
- name: silyl_count
dtype: int64
- name: silyene_count
dtype: int64
- name: sorboyl_count
dtype: int64
- name: stearoyl_count
dtype: int64
- name: stearyl_count
dtype: int64
- name: styryl_count
dtype: int64
- name: suberoyl_count
dtype: int64
- name: succinyl_count
dtype: int64
- name: sulfamino_count
dtype: int64
- name: sulfamoyl_count
dtype: int64
- name: sulfanilyl_count
dtype: int64
- name: sulfeno_count
dtype: int64
- name: sulfhydryl_count
dtype: int64
- name: sulfinyl_count
dtype: int64
- name: sulfo_count
dtype: int64
- name: sulfonyl_count
dtype: int64
- name: terephthaloyl_count
dtype: int64
- name: tetramethylene_count
dtype: int64
- name: thienyl_count
dtype: int64
- name: thiocarbonyl_count
dtype: int64
- name: thiocarboxy_count
dtype: int64
- name: thiocyanato_count
dtype: int64
- name: thionyl_count
dtype: int64
- name: threonyl_count
dtype: int64
- name: toluidino_count
dtype: int64
- name: toluoyl_count
dtype: int64
- name: tolyl_count
dtype: int64
- name: alpha-tolyl_count
dtype: int64
- name: tolylene_count
dtype: int64
- name: tosyl_count
dtype: int64
- name: triazano_count
dtype: int64
- name: trimethylene_count
dtype: int64
- name: valeryl_count
dtype: int64
- name: valyl_count
dtype: int64
- name: vinyl_count
dtype: int64
- name: vinylidene_count
dtype: int64
- name: xylidino_count
dtype: int64
- name: xylyl_count
dtype: int64
- name: xylylene_count
dtype: int64
- name: propiolamide_count
dtype: int64
- name: fumarate ester_count
dtype: int64
- name: allenamide_count
dtype: int64
- name: propiolonitrile_count
dtype: int64
- name: propargylamide_count
dtype: int64
- name: arylsulfonyl bicyclobutane_count
dtype: int64
- name: haloalkane_count
dtype: int64
- name: alpha-halomethyl_count
dtype: int64
- name: alpha-haloamide_count
dtype: int64
- name: alpha-haloester_count
dtype: int64
- name: epoxide_count
dtype: int64
- name: aziridine_count
dtype: int64
- name: nitroalkane_count
dtype: int64
- name: acrylamide_count
dtype: int64
- name: cyanoenone_count
dtype: int64
- name: aldehyde_count
dtype: int64
- name: ketone_count
dtype: int64
- name: nitrile_count
dtype: int64
- name: cyanamide_count
dtype: int64
- name: isothicyanate_count
dtype: int64
- name: sulfone_count
dtype: int64
- name: sulfonyl fluoride_count
dtype: int64
- name: sulfonimidoyl fluoride_count
dtype: int64
- name: aryl fluorosulfate_count
dtype: int64
- name: ester_count
dtype: int64
- name: sulfonamide_count
dtype: int64
- name: 2-carbonyl arylboronic acid_count
dtype: int64
- name: n-methyl isoxazolium_count
dtype: int64
- name: oxaziridine_count
dtype: int64
- name: carboxyl_count
dtype: int64
- name: ether_count
dtype: int64
- name: alkanol_count
dtype: int64
- name: thiol_count
dtype: int64
- name: halogen_count
dtype: int64
- name: amine_count
dtype: int64
- name: amide_count
dtype: int64
- name: num_valence_electrons
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- name: rotable_proportion
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- name: non_rotable_proportion
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- name: num_unspecified_bond
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- name: num_quadruple_bonds
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- name: num_quintuple_bonds
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- name: num_hextuple_bonds
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- name: num_oneandahalf_bonds
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- name: num_twoandahalf_bonds
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- name: num_threeandahalf_bonds
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- name: num_fourandahalf_bonds
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- name: num_fiveandahalf_bonds
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- name: num_aromatic_bonds
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- name: num_ionic_bonds
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- name: num_hydrogen_bonds
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- name: num_threecenter_bonds
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- name: num_dativeone_bonds
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- name: num_dative_bonds
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- name: num_other_bonds
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- name: hydrogen_mass
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- name: nitrogen_mass
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- name: oxygen_mass
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- name: num_carbon_atoms
dtype: int64
- name: num_hydrogen_atoms
dtype: int64
- name: num_nitrogen_atoms
dtype: int64
- name: num_oxygen_atoms
dtype: int64
- name: num_hydrogen_bond_acceptors
dtype: int64
- name: num_hydrogen_bond_donors
dtype: int64
- name: num_lipinski_violations
dtype: int64
- name: inertial_shape_factor
dtype: float64
- name: eccentricity
dtype: float64
- name: asphericity
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- name: npr1_value
dtype: float64
- name: npr2_value
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- name: pmi1_value
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- name: pmi2_value
dtype: float64
- name: pmi3_value
dtype: float64
- name: num_chiral_centers
dtype: int64
- name: representation
dtype: string
splits:
- name: train
num_bytes: 2757656
num_examples: 500
download_size: 490741
dataset_size: 2757656
- config_name: rdkit_feat_8
features:
- name: tert-butyloxycarbonyl_count
dtype: int64
- name: representation_type
dtype: string
- name: trityl_count
dtype: int64
- name: 3,5-dimethoxyphenylisoproxycarbonyl_count
dtype: int64
- name: 2-(4-biphenyl)isopropoxycarbonyl_count
dtype: int64
- name: 2-nitrophenylsulfenyl_count
dtype: int64
- name: boc_count
dtype: int64
- name: trt_count
dtype: int64
- name: ddz_count
dtype: int64
- name: bpoc_count
dtype: int64
- name: nps_count
dtype: int64
- name: 9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: 2-(4-nitrophenylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: (1,1-dioxobenzo[b]thiophene-2-yl)methyloxycarbonyl_count
dtype: int64
- name: (1,1-dioxonaptho[1,2-b]thiophene-2-yl)methyloxycarbonyl_count
dtype: int64
- name: 1-(4,4-dimethyl-2,6-dioxocyclohex-1-ylidene)-3-methylbutyl_count
dtype: int64
- name: 2,7-di-tert-butyl-fmoc_count
dtype: int64
- name: 2-fluoro-fmoc_count
dtype: int64
- name: 2-monoisooctyl-fmoc_count
dtype: int64
- name: 2,7-diisooctyl-fmoc_count
dtype: int64
- name: tetrachlorophthaloyl_count
dtype: int64
- name: 2-[phenyl(methyl)sulfonio])ethyloxycarbonyltetrafluoroborate_count
dtype: int64
- name: ethanesulfonylethoxycarbonyl_count
dtype: int64
- name: 2-(4-sulfophenylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: fmoc_count
dtype: int64
- name: nsc_count
dtype: int64
- name: bsmoc_count
dtype: int64
- name: alpha-nsmoc_count
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- name: ivdde_count
dtype: int64
- name: fmoc*_count
dtype: int64
- name: fmoc(fmoc(2f))_count
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- name: mio-fmoc_count
dtype: int64
- name: dio-fmoc_count
dtype: int64
- name: tcp_count
dtype: int64
- name: pms_count
dtype: int64
- name: esc_count
dtype: int64
- name: sps_count
dtype: int64
- name: benzyloxycarbonyl_count
dtype: int64
- name: allyloxycarbonyl_count
dtype: int64
- name: o-nitrobenzenesulfonyl_count
dtype: int64
- name: 2,4-dinitrobenzenesulfonyl_count
dtype: int64
- name: benzothiazole-2-sulfonyl_count
dtype: int64
- name: 2,2,2-trichloroethyloxycarbonyl_count
dtype: int64
- name: dithiasuccinoyl_count
dtype: int64
- name: p-nitrobenzyloxycarbonyl_count
dtype: int64
- name: alpha-azidoacids_count
dtype: int64
- name: proparglyoxycarbonyl_count
dtype: int64
- name: o-nitrobenzylcarbonyl_count
dtype: int64
- name: 4-nitroveratryloxycarbonyl_count
dtype: int64
- name: 2-(2-nitrophenyl)propyloxycarbonyl_count
dtype: int64
- name: 2-(3,4-methylenedioxy-6-nitrophenyl)propyloxycarbonyl_count
dtype: int64
- name: 9-(4-bromophenyl)-9-fluorenyl_count
dtype: int64
- name: azidomethoxycarbonyl_count
dtype: int64
- name: hexafluoroacetone_count
dtype: int64
- name: Z_count
dtype: int64
- name: alloc_count
dtype: int64
- name: o-nbs_count
dtype: int64
- name: d-nbs_count
dtype: int64
- name: bts_count
dtype: int64
- name: troc_count
dtype: int64
- name: dts_count
dtype: int64
- name: pnz_count
dtype: int64
- name: poc_count
dtype: int64
- name: onz_count
dtype: int64
- name: nvoc_count
dtype: int64
- name: nppoc_count
dtype: int64
- name: mnppoc_count
dtype: int64
- name: brphf_count
dtype: int64
- name: azoc_count
dtype: int64
- name: hfa_count
dtype: int64
- name: 2-chlorobenzyloxycarbonyl_count
dtype: int64
- name: 4-methyltrityl_count
dtype: int64
- name: cl-z_count
dtype: int64
- name: mtt_count
dtype: int64
- name: 1-(4,4-dimethyl-2,6-dioxocylohex-1-ylidene)-3-methylbutyl_count
dtype: int64
- name: trifluoroacetyl_count
dtype: int64
- name: 2-(methylsulfonyl)ethoxycarbonyl_count
dtype: int64
- name: tfa_count
dtype: int64
- name: msc_count
dtype: int64
- name: phenyldisulphanylethyloxycarbonyl_count
dtype: int64
- name: 2-pyridyldisulphanylethyloxycarbonyl_count
dtype: int64
- name: phdec_count
dtype: int64
- name: pydec_count
dtype: int64
- name: tert-butyl_count
dtype: int64
- name: 2-chlorotrityl_count
dtype: int64
- name: 2-4-dimethyoxybenzyl_count
dtype: int64
- name: 2-phenylisopropyl_count
dtype: int64
- name: 5-phenyl-3,4-ethylenedioxythenyl_count
dtype: int64
- name: bu_count
dtype: int64
- name: 2-cl-trt_count
dtype: int64
- name: dmb_count
dtype: int64
- name: 2-ph-pr_count
dtype: int64
- name: phenyl-edotn_count
dtype: int64
- name: 9-fluorenylmethyl_count
dtype: int64
- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocylocheylidene)-3-methylbutyl]-amino)benzyl_count
dtype: int64
- name: methyl_count
dtype: int64
- name: ethyl_count
dtype: int64
- name: carbamoylmethyl_count
dtype: int64
- name: fm_count
dtype: int64
- name: dmab_count
dtype: int64
- name: me_count
dtype: int64
- name: et_count
dtype: int64
- name: cam_count
dtype: int64
- name: allyl_count
dtype: int64
- name: benzyl_count
dtype: int64
- name: phenacyl_count
dtype: int64
- name: p-nitrobenzyl_count
dtype: int64
- name: 2-trimethylsilyethyl_count
dtype: int64
- name: (2-phenyl-2-trimethylsilyl)ethyl_count
dtype: int64
- name: 2-(trimethylsilyl)isopropyl_count
dtype: int64
- name: 2,2,2-trichloroethyl_count
dtype: int64
- name: p-hydroxyphenacyl_count
dtype: int64
- name: 4,5-dimethyoxy-2-nitrobenzyl_count
dtype: int64
- name: 1,1-dimethylallyl_count
dtype: int64
- name: pentaaminecobalt_III_count
dtype: int64
- name: al_count
dtype: int64
- name: bn_count
dtype: int64
- name: pac_count
dtype: int64
- name: pnb_count
dtype: int64
- name: tmse_count
dtype: int64
- name: ptmse_count
dtype: int64
- name: tmsi_count
dtype: int64
- name: tce_count
dtype: int64
- name: php_count
dtype: int64
- name: dmnb_count
dtype: int64
- name: dma_count
dtype: int64
- name: cyclohexyl_count
dtype: int64
- name: b-menthyl_count
dtype: int64
- name: b-3-methylpent-3-yl_count
dtype: int64
- name: 4-(3,6,9-trioxadecyl)oxybenzyl_count
dtype: int64
- name: chx_count
dtype: int64
- name: men_count
dtype: int64
- name: mpe_count
dtype: int64
- name: tegbz_count
dtype: int64
- name: 9-fluoroenylmethyl_count
dtype: int64
- name: 4-(N-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-methyl-butyl]-amino)benzyl_count
dtype: int64
- name: trimethylsilylethyl_count
dtype: int64
- name: 4,5-dimethoxy-2-nitrobenzyloxycarbonyl_count
dtype: int64
- name: pseudoprolines_count
dtype: int64
- name: 2-hydroxy-4-methoxybenzyl_count
dtype: int64
- name: 2,4-dimethoxybenzyl_count
dtype: int64
- name: 2,4,6-trimethoxybenzyl_count
dtype: int64
- name: 1-methyl-3-indolylmethyl_count
dtype: int64
- name: 3,4-ethylene-dioxy-2-thenyl_count
dtype: int64
- name: hmb_count
dtype: int64
- name: tmob_count
dtype: int64
- name: mim_count
dtype: int64
- name: edot_count
dtype: int64
- name: 4-methoxy-2-nitro-benzyl_count
dtype: int64
- name: (6-hydroxy-3-oxido-1,3-benz[d]oxathiol-5-yl)methyl_count
dtype: int64
- name: 2-hydroxy-4-methoxy-5-(methylsulfinyl)benzyl_count
dtype: int64
- name: n-boc-n-methyl[2-(methylamino)ethyl]carbamoyl-hmb_count
dtype: int64
- name: 9-xanthenyl_count
dtype: int64
- name: cyclopropyldimethylcarbinyl_count
dtype: int64
- name: 4,4-dimethoxybenzhydryl_count
dtype: int64
- name: xan_count
dtype: int64
- name: cpd_count
dtype: int64
- name: mbh_count
dtype: int64
- name: p-toluenesulfonyl_count
dtype: int64
- name: 2,2,5,7,8-pentamethylchroman-6-sulfonyl_count
dtype: int64
- name: 2,2,4,6,7-pentamethyl-2,3-dihydrobenzofuran-5-sulfonyl_count
dtype: int64
- name: mesityl-2-sulfonyl_count
dtype: int64
- name: 4-methoxy-2,3,6-trimethylphenylsulfonyl_count
dtype: int64
- name: 1,2-dimethylindole-3-sulfonyl_count
dtype: int64
- name: w,w-bis-tert-butyloxycarbonyl_count
dtype: int64
- name: 5-dibenzosuberenyl_count
dtype: int64
- name: 5-dibenzosuberyl_count
dtype: int64
- name: 2-methoxy-5-dibenzosuberyl_count
dtype: int64
- name: nitro_count
dtype: int64
- name: tos_count
dtype: int64
- name: pmc_count
dtype: int64
- name: pbf_count
dtype: int64
- name: mts_count
dtype: int64
- name: mtr_count
dtype: int64
- name: mis_count
dtype: int64
- name: bis-boc_count
dtype: int64
- name: suben_count
dtype: int64
- name: sub_count
dtype: int64
- name: mesub_count
dtype: int64
- name: no2_count
dtype: int64
- name: w,w-bis-benzyloxycarbonyl_count
dtype: int64
- name: w,w-bis-allyloxycarbonyl_count
dtype: int64
- name: z-small_count
dtype: int64
- name: p-methylbenzyl_count
dtype: int64
- name: p-methoxybenzyl_count
dtype: int64
- name: monomethoxytrityl_count
dtype: int64
- name: trimethoxybenzyl_count
dtype: int64
- name: 2,2,4,6,7-pentamethyl-5-dihydrobenzofuranylmethyl_count
dtype: int64
- name: 1-adamantyl_count
dtype: int64
- name: meb_count
dtype: int64
- name: mob_count
dtype: int64
- name: mmt_count
dtype: int64
- name: pmbf_count
dtype: int64
- name: 1-ada_count
dtype: int64
- name: 2-(2,4-dinitrophenyl)ethyl_count
dtype: int64
- name: 9-fluororenylmethoxycarbonyl_count
dtype: int64
- name: dnpe_count
dtype: int64
- name: acetamidomethyl_count
dtype: int64
- name: phenylacetamidomethyl_count
dtype: int64
- name: 5-tert-butylmercapto_count
dtype: int64
- name: 3-nitro-2-pyridinesulfenyl_count
dtype: int64
- name: 2-pyridinesulfenyl_count
dtype: int64
- name: N-allyloxycarbonyl-N-[2,3,5,6-tetrafluoro-4-(phenylthio)phenyl]]aminomethyl_count
dtype: int64
- name: o-nitrobenzyl_count
dtype: int64
- name: 4-picolyl_count
dtype: int64
- name: ninhydrin_count
dtype: int64
- name: acm_count
dtype: int64
- name: phacm_count
dtype: int64
- name: sbu_count
dtype: int64
- name: npys_count
dtype: int64
- name: s-pyr_count
dtype: int64
- name: fsam_count
dtype: int64
- name: onb_count
dtype: int64
- name: nin_count
dtype: int64
- name: n-tosyl_count
dtype: int64
- name: n-trityl_count
dtype: int64
- name: n-monomethoxytrityl_count
dtype: int64
- name: n-methyltrityl_count
dtype: int64
- name: n-tert-butyloxycarbonyl_count
dtype: int64
- name: n-2,4-dimethylpent-3-yloxycarbonyl_count
dtype: int64
- name: n-benzyloxymethyl_count
dtype: int64
- name: n-tert-butoxymethyl_count
dtype: int64
- name: ntos_count
dtype: int64
- name: ntrt_count
dtype: int64
- name: nmtt_count
dtype: int64
- name: nmmt_count
dtype: int64
- name: nboc_count
dtype: int64
- name: ndoc_count
dtype: int64
- name: nbom_count
dtype: int64
- name: nbum_count
dtype: int64
- name: N-9-fluorenylmethoxycarbonyl_count
dtype: int64
- name: N-2,6-dimethoxybenzoyl_count
dtype: int64
- name: dmbz_count
dtype: int64
- name: N-2,4-dinitrophenyl_count
dtype: int64
- name: dnp_count
dtype: int64
- name: cyclohexyl;_count
dtype: int64
- name: tert-butyldimethylsilyl_count
dtype: int64
- name: tbdms_count
dtype: int64
- name: tert-butyldiphenylsilyl_count
dtype: int64
- name: propargyloxycarbonyl_count
dtype: int64
- name: tbdps_count
dtype: int64
- name: 2,6-dichlorobenzyl_count
dtype: int64
- name: 2-bromobenzyl_count
dtype: int64
- name: 2-bromobenzyloxycarbonyl_count
dtype: int64
- name: 3-pentyl_count
dtype: int64
- name: dcb_count
dtype: int64
- name: brbn_count
dtype: int64
- name: brz_count
dtype: int64
- name: pen_count
dtype: int64
- name: tegb_count
dtype: int64
- name: boc-n-methyl-n-[2-(methylamino)ethyl]carbamoyl_count
dtype: int64
- name: boc-nmec_count
dtype: int64
- name: formyl_count
dtype: int64
- name: cyclohexyloxycarbonyl_count
dtype: int64
- name: for_count
dtype: int64
- name: hoc_count
dtype: int64
- name: cyclopropane_count
dtype: int64
- name: spiropentane_count
dtype: int64
- name: cyclobutane_count
dtype: int64
- name: cyclopentane_count
dtype: int64
- name: furan_count
dtype: int64
- name: thiophene_count
dtype: int64
- name: pyrrole_count
dtype: int64
- name: 2H-pyrrole_count
dtype: int64
- name: 3H-pyrrole_count
dtype: int64
- name: pyrazole_count
dtype: int64
- name: 2H-imidazole_count
dtype: int64
- name: 1,2,3-triazole_count
dtype: int64
- name: 1,2,4-triazole_count
dtype: int64
- name: 1,2-dithiole_count
dtype: int64
- name: 1,3-dithiole_count
dtype: int64
- name: 3H-1,2-oxathiole_count
dtype: int64
- name: isoxazole_count
dtype: int64
- name: oxazole_count
dtype: int64
- name: thiazole_count
dtype: int64
- name: isothiazole_count
dtype: int64
- name: 1,2,3-oxadiazole_count
dtype: int64
- name: 1,2,4-oxadiazole_count
dtype: int64
- name: 1,2,5-oxadiazole_count
dtype: int64
- name: 1,3,4-oxadiazole_count
dtype: int64
- name: 1,2,3,4-oxatriazole_count
dtype: int64
- name: 1,2,3,5-oxatriazole_count
dtype: int64
- name: 3H-1,2,3-dioxazole_count
dtype: int64
- name: 1,2,4-dioxazole_count
dtype: int64
- name: 1,3,2-dioxazole_count
dtype: int64
- name: 1,3,4-dioxazole_count
dtype: int64
- name: 5H-1,2,5-oxathiazole_count
dtype: int64
- name: 1,3-oxathiole_count
dtype: int64
- name: benzene_count
dtype: int64
- name: cyclohexane_count
dtype: int64
- name: 2H-pyran_count
dtype: int64
- name: 4H-pyran_count
dtype: int64
- name: 2H-pyran-2-one_count
dtype: int64
- name: 4H-pyran-4-one_count
dtype: int64
- name: 1,2-dioxin_count
dtype: int64
- name: 1,3-dioxin_count
dtype: int64
- name: pyridine_count
dtype: int64
- name: pyridazine_count
dtype: int64
- name: pyrimidine_count
dtype: int64
- name: pyrazine_count
dtype: int64
- name: piperazine_count
dtype: int64
- name: 1,3,5-triazine_count
dtype: int64
- name: 1,2,4-triazine_count
dtype: int64
- name: 1,2,3-triazine_count
dtype: int64
- name: 4H-1,2-Oxazine_count
dtype: int64
- name: 2H-1,3-Oxazine_count
dtype: int64
- name: 6H-1,3-Oxazine_count
dtype: int64
- name: 6H-1,2-Oxazine_count
dtype: int64
- name: 1,4-Oxazine_count
dtype: int64
- name: 2H-1,2-Oxazine_count
dtype: int64
- name: 4H-1,4-Oxazine_count
dtype: int64
- name: 1,2,5-Oxathiazine_count
dtype: int64
- name: 1,2,6-Oxathiazine_count
dtype: int64
- name: 1,2,4-Oxadiazine_count
dtype: int64
- name: 1,3,5-Oxadiazine_count
dtype: int64
- name: morpholine_count
dtype: int64
- name: azepine_count
dtype: int64
- name: oxepin_count
dtype: int64
- name: thiepin_count
dtype: int64
- name: 4H-1,2-diazepine_count
dtype: int64
- name: indene_count
dtype: int64
- name: 2H-indene_count
dtype: int64
- name: benzofuran_count
dtype: int64
- name: isobenzofuran_count
dtype: int64
- name: benzo[b]thiophene_count
dtype: int64
- name: benzo[c]thiophene_count
dtype: int64
- name: indole_count
dtype: int64
- name: 3H-indole_count
dtype: int64
- name: 1H-indole_count
dtype: int64
- name: cyclopenta[b]pyridine_count
dtype: int64
- name: pyrano[3,4-b]-pyrrole_count
dtype: int64
- name: indazole_count
dtype: int64
- name: benzisoxazole_count
dtype: int64
- name: benzoxazole_count
dtype: int64
- name: 2,1-benzisoxazole_count
dtype: int64
- name: naphthalene_count
dtype: int64
- name: 1,2,3,4-tetrahydronaphthalene_count
dtype: int64
- name: octahydronaphthalene_count
dtype: int64
- name: 2H-1-benzopyran_count
dtype: int64
- name: 2H-1-benzopyran-2-one_count
dtype: int64
- name: 4H-1-benzopyran-4-one_count
dtype: int64
- name: 1H-2-benzopyran-1-one_count
dtype: int64
- name: 3H-2-benzopyran-1-one_count
dtype: int64
- name: quinoline_count
dtype: int64
- name: isoquinoline_count
dtype: int64
- name: cinnoline_count
dtype: int64
- name: quinazoline_count
dtype: int64
- name: 1,8-napthyhridine_count
dtype: int64
- name: 1,7-napththyridine_count
dtype: int64
- name: 1,5-napththridine_count
dtype: int64
- name: 1,6-napthyridine_count
dtype: int64
- name: 2H-1,3-benzoxazine_count
dtype: int64
- name: 2H-1,4-benzoxazine_count
dtype: int64
- name: 1H-2,3-benzoxazine_count
dtype: int64
- name: 4H-3,1-benzoxazine_count
dtype: int64
- name: 2H-1,2-benzoxazine_count
dtype: int64
- name: 4H-1,3-benzoxazine_count
dtype: int64
- name: anthracene_count
dtype: int64
- name: phenanthrene_count
dtype: int64
- name: phenalene_count
dtype: int64
- name: fluorene_count
dtype: int64
- name: carbazole_count
dtype: int64
- name: xanthene_count
dtype: int64
- name: acridine_count
dtype: int64
- name: norpinane_count
dtype: int64
- name: 7H-purine_count
dtype: int64
- name: steroid_ring_system_count
dtype: int64
- name: imidazole_count
dtype: int64
- name: thiazol-2-amine_count
dtype: int64
- name: tetrazole_count
dtype: int64
- name: cytosine_count
dtype: int64
- name: adenine_count
dtype: int64
- name: 5-methylindole_count
dtype: int64
- name: isocaffeine_count
dtype: int64
- name: tetrazolethiol_count
dtype: int64
- name: 3-methylisoxazole_count
dtype: int64
- name: 1-methylimidazole_count
dtype: int64
- name: 2-methylimidazole_count
dtype: int64
- name: guanine_count
dtype: int64
- name: tosufloxacin_count
dtype: int64
- name: acetamido_count
dtype: int64
- name: acetoacetyl_count
dtype: int64
- name: acetyl_count
dtype: int64
- name: acryloyl_count
dtype: int64
- name: alanyl_count
dtype: int64
- name: beta-alanyl_count
dtype: int64
- name: allylidene_count
dtype: int64
- name: amidino_count
dtype: int64
- name: amino_count
dtype: int64
- name: amyl_count
dtype: int64
- name: anilino_count
dtype: int64
- name: anisidino_count
dtype: int64
- name: anthranoyl_count
dtype: int64
- name: arsino_count
dtype: int64
- name: azelaoyl_count
dtype: int64
- name: azido_count
dtype: int64
- name: azo_count
dtype: int64
- name: azoxy_count
dtype: int64
- name: benzal_count
dtype: int64
- name: benzamido_count
dtype: int64
- name: benzhydrol_count
dtype: int64
- name: benzoxy_count
dtype: int64
- name: benzoyl_count
dtype: int64
- name: benzylidene_count
dtype: int64
- name: benzylidyne_count
dtype: int64
- name: biphenylyl_count
dtype: int64
- name: biphenylene_count
dtype: int64
- name: butoxy_count
dtype: int64
- name: sec-butoxy_count
dtype: int64
- name: tert-butoxy_count
dtype: int64
- name: butyl_count
dtype: int64
- name: sec-butyl_count
dtype: int64
- name: butyryl_count
dtype: int64
- name: caproyl_count
dtype: int64
- name: capryl_count
dtype: int64
- name: capryloyl_count
dtype: int64
- name: carbamido_count
dtype: int64
- name: carbamoyl_count
dtype: int64
- name: carbamyl_count
dtype: int64
- name: carbazoyl_count
dtype: int64
- name: carbethoxy_count
dtype: int64
- name: carbonyl_count
dtype: int64
- name: carboxy_count
dtype: int64
- name: cetyl_count
dtype: int64
- name: chloroformyl_count
dtype: int64
- name: cinnamoyl_count
dtype: int64
- name: cinnamyl_count
dtype: int64
- name: cinnamylidene_count
dtype: int64
- name: cresyl_count
dtype: int64
- name: crotonoyl_count
dtype: int64
- name: crotyl_count
dtype: int64
- name: cyanamido_count
dtype: int64
- name: cyanato_count
dtype: int64
- name: cyano_count
dtype: int64
- name: decanedioyl_count
dtype: int64
- name: decanoyl_count
dtype: int64
- name: diazo_count
dtype: int64
- name: diazoamino_count
dtype: int64
- name: disilanyl_count
dtype: int64
- name: disiloxanyloxy_count
dtype: int64
- name: disulfinyl_count
dtype: int64
- name: dithio_count
dtype: int64
- name: enanthoyl_count
dtype: int64
- name: epoxy_count
dtype: int64
- name: ethenyl_count
dtype: int64
- name: ethynyl_count
dtype: int64
- name: ethoxy_count
dtype: int64
- name: ethylene_count
dtype: int64
- name: ethylidene_count
dtype: int64
- name: ethylthio_count
dtype: int64
- name: formamido_count
dtype: int64
- name: furmaroyl_count
dtype: int64
- name: furfuryl_count
dtype: int64
- name: furfurylidene_count
dtype: int64
- name: glutamoyl_count
dtype: int64
- name: glutaryl_count
dtype: int64
- name: glycylamino_count
dtype: int64
- name: glycoloyl_count
dtype: int64
- name: glycyl_count
dtype: int64
- name: glyoxyoyl_count
dtype: int64
- name: guanidino_count
dtype: int64
- name: guanyl_count
dtype: int64
- name: heptadecanoyl_count
dtype: int64
- name: heptanamido_count
dtype: int64
- name: heptanoyl_count
dtype: int64
- name: hexadecanoyl_count
dtype: int64
- name: hexamethylene_count
dtype: int64
- name: hexanedioyl_count
dtype: int64
- name: hippuryl_count
dtype: int64
- name: hydrazino_count
dtype: int64
- name: hydrazo_count
dtype: int64
- name: hydrocinnamoyl_count
dtype: int64
- name: hydroperoxy_count
dtype: int64
- name: hydroxyamino_count
dtype: int64
- name: imino_count
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---
# Dataset Card for "chemnlp-chem-caption"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 350,105 | [
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Jimmyhd/stable-diffusion-training | 2023-10-25T01:07:22.000Z | [
"region:us"
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abhii26/bert | 2023-10-25T10:43:07.000Z | [
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dcbv/charluv-dataset | 2023-10-25T11:07:28.000Z | [
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MananSantoki/vadodara-jsonl-converted | 2023-10-25T11:29:27.000Z | [
"region:us"
] | MananSantoki | null | null | 0 | 4 | 2023-10-25T11:29:26 | ---
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---
# Dataset Card for "vadodara-jsonl-converted"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 447 | [
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jamestalentium/xsum_250_rm | 2023-10-25T18:11:07.000Z | [
"region:us"
] | jamestalentium | null | null | 0 | 4 | 2023-10-25T18:11:06 | ---
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---
# Dataset Card for "xsum_250_rm"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 534 | [
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schae44/testLabeledDataset | 2023-10-31T23:35:32.000Z | [
"region:us"
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Phaedrus/rsna_5k | 2023-10-26T04:21:12.000Z | [
"region:us"
] | Phaedrus | null | null | 0 | 4 | 2023-10-26T04:17:37 | ---
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---
# Dataset Card for "rsna_5k"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 583 | [
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Phaedrus/rsna_5k_ii | 2023-10-26T05:59:24.000Z | [
"region:us"
] | Phaedrus | null | null | 0 | 4 | 2023-10-26T05:55:57 | ---
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---
# Dataset Card for "rsna_5k_ii"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 586 | [
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Ryan20/hotel_data1_pushed | 2023-10-26T09:40:12.000Z | [
"region:us"
] | Ryan20 | null | null | 0 | 4 | 2023-10-26T09:40:10 | ---
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# Dataset Card for "hotel_data1_pushed"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 440 | [
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faizalnf1800/yelp_review_full_preprocessed | 2023-10-26T13:18:27.000Z | [
"license:afl-3.0",
"region:us"
] | faizalnf1800 | null | null | 0 | 4 | 2023-10-26T12:42:41 | ---
license: afl-3.0
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---
This Dataset Preprocessed Using NLTK Library. Tokenize,Lemmatize,Lower,Stopword for easier to analyze by ML Model
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Back-up/UIT-Squad-test | 2023-10-26T13:11:07.000Z | [
"region:us"
] | Back-up | null | null | 0 | 4 | 2023-10-26T13:11:05 | ---
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path: data/train-*
---
# Dataset Card for "UIT-Squad-test"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 703 | [
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JLB-JLB/seizure_eeg_greyscale_224x224_6secWindow_adjusted | 2023-10-26T13:33:30.000Z | [
"region:us"
] | JLB-JLB | null | null | 0 | 4 | 2023-10-26T13:20:48 | ---
configs:
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---
# Dataset Card for "seizure_eeg_greyscale_224x224_6secWindow_adjusted"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 850 | [
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TheAIchemist13/hindi_asr_dataset_accent | 2023-11-01T05:26:24.000Z | [
"region:us"
] | TheAIchemist13 | null | null | 0 | 4 | 2023-10-26T13:44:12 | ---
configs:
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---
# Dataset Card for "hindi_asr_dataset_accent"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 635 | [
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pglo/NeurIPS_llm_challenge | 2023-10-26T14:38:20.000Z | [
"region:us"
] | pglo | null | null | 0 | 4 | 2023-10-26T14:27:18 | Entry not found | 15 | [
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chirunder/GRE_words_gregmat-marriam_webster | 2023-10-27T04:00:11.000Z | [
"region:us"
] | chirunder | null | null | 0 | 4 | 2023-10-27T03:59:56 | ---
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path: data/train-*
---
# Dataset Card for "GRE_words_gregmat-marriam_webster"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 500 | [
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Phaedrus/rsna_5k_512_b | 2023-10-27T10:47:31.000Z | [
"region:us"
] | Phaedrus | null | null | 0 | 4 | 2023-10-27T10:42:12 | ---
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path: data/train-*
---
# Dataset Card for "rsna_5k_512_b"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 589 | [
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kheopsai/mise_demeure | 2023-10-27T14:15:07.000Z | [
"region:us"
] | kheopsai | null | null | 0 | 4 | 2023-10-27T14:14:44 | Entry not found | 15 | [
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Morevorot/Dog_breed_Japanese_Spitz | 2023-10-30T15:49:24.000Z | [
"size_categories:1K<n<10K",
"license:cc-by-sa-4.0",
"region:us"
] | Morevorot | null | null | 0 | 4 | 2023-10-27T14:23:53 | ---
license: cc-by-sa-4.0
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size_categories:
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---
Japanese Spitz, resolution above 256x256, no 1 to 1 copies (but there are processed versions of one photo), serial names.
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rag-datasets/mini_wikipedia | 2023-10-28T08:55:16.000Z | [
"task_categories:question-answering",
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"size_categories:n<1K",
"language:en",
"license:cc-by-3.0",
"rag",
"wikipedia",
"open-domain",
"information-retrieval",
"dpr",
"region:us"
] | rag-datasets | null | null | 0 | 4 | 2023-10-27T15:50:06 | ---
license: cc-by-3.0
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path: "data/passages.parquet/*"
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data_files:
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path: "data/test.parquet/*"
---
Derives from https://www.kaggle.com/datasets/rtatman/questionanswer-dataset?resource=download we generated our own subset using `generate.py`.
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linhtran92/tts_997 | 2023-10-27T17:14:02.000Z | [
"region:us"
] | linhtran92 | null | null | 0 | 4 | 2023-10-27T17:13:56 | ---
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---
# Dataset Card for "tts_997"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 664 | [
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vigneshm1995/cancer_image_dataset | 2023-10-27T18:20:58.000Z | [
"region:us"
] | vigneshm1995 | null | null | 0 | 4 | 2023-10-27T18:12:28 | ---
configs:
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---
# Dataset Card for "cancer_image_dataset"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 466 | [
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thanhduycao/soict_private_test_v1 | 2023-10-28T06:49:23.000Z | [
"region:us"
] | thanhduycao | null | null | 0 | 4 | 2023-10-28T06:37:35 | ---
configs:
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---
# Dataset Card for "soict_private_test_v1"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 605 | [
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automated-research-group/gpt2-winogrande-results | 2023-11-03T01:09:41.000Z | [
"region:us"
] | automated-research-group | null | null | 0 | 4 | 2023-10-28T06:51:22 | ---
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---
# Dataset Card for "gpt2-winogrande-results"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 10,255 | [
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szymonrucinski/pan-tadeusz | 2023-10-28T09:59:42.000Z | [
"region:us"
] | szymonrucinski | null | null | 0 | 4 | 2023-10-28T09:58:08 | ---
configs:
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---
# Dataset Card for "pan-tadeusz"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 548 | [
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Arham-Imran/test_cityscape | 2023-10-28T15:09:58.000Z | [
"region:us"
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ekuhn/ds_rplanpy_floorplan_to_color | 2023-10-28T15:29:16.000Z | [
"region:us"
] | ekuhn | null | null | 0 | 4 | 2023-10-28T15:29:01 | ---
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---
# Dataset Card for "ds_rplanpy_floorplan_to_color"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 571 | [
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exponent/bigmaths | 2023-10-28T19:11:14.000Z | [
"region:us"
] | exponent | null | null | 0 | 4 | 2023-10-28T19:04:25 | Entry not found | 15 | [
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ixarchakos/dresses_warped | 2023-10-28T20:31:26.000Z | [
"region:us"
] | ixarchakos | null | null | 0 | 4 | 2023-10-28T20:09:13 | Entry not found | 15 | [
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ialvarenga/acl-arc-revised | 2023-10-28T22:40:25.000Z | [
"region:us"
] | ialvarenga | null | null | 0 | 4 | 2023-10-28T22:40:16 | ---
configs:
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---
# Dataset Card for "acl-arc-revised"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 845 | [
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dq158/hehe | 2023-10-29T19:25:15.000Z | [
"region:us"
] | dq158 | null | null | 0 | 4 | 2023-10-29T04:01:22 | Entry not found | 15 | [
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skvarre/movie_posters-100k-torchvision | 2023-10-29T07:27:08.000Z | [
"region:us"
] | skvarre | null | null | 0 | 4 | 2023-10-29T07:04:02 | ---
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---
# Dataset Card for "movie_posters-100k-torchvision"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 976 | [
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AudioDecBenchmark/cv_13_zh_tw | 2023-10-31T03:08:09.000Z | [
"region:us"
] | AudioDecBenchmark | null | null | 0 | 4 | 2023-10-29T08:28:04 | ---
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---
# Dataset Card for "cv_13_zh_tw"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 944 | [
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li-ping/all_pdf_dataset_1029_416data | 2023-10-29T10:35:20.000Z | [
"region:us"
] | li-ping | null | null | 0 | 4 | 2023-10-29T10:32:04 | ---
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---
# Dataset Card for "all_pdf_dataset_1029_416data"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 480 | [
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Sathvik-24/chachaOrganised300 | 2023-10-29T12:58:10.000Z | [
"region:us"
] | Sathvik-24 | null | null | 0 | 4 | 2023-10-29T12:43:04 | Entry not found | 15 | [
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sbhowmick12/northeast_vqa | 2023-10-29T14:34:31.000Z | [
"region:us"
] | sbhowmick12 | null | null | 0 | 4 | 2023-10-29T14:33:53 | Entry not found | 15 | [
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automated-research-group/llama2_7b_bf16-winogrande-results | 2023-10-30T07:15:44.000Z | [
"region:us"
] | automated-research-group | null | null | 0 | 4 | 2023-10-30T03:43:31 | ---
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path: '{''do_sample''=True, ''beams''=1, ''temperature''=1.0, ''top_k''=1000,
''top_p''=0.1}/train-*'
- config_name: '{''do_sample''=True, ''beams''=1, ''temperature''=1.0, ''top_k''=1000,
''top_p''=0.2}'
data_files:
- split: train
path: '{''do_sample''=True, ''beams''=1, ''temperature''=1.0, ''top_k''=1000,
''top_p''=0.2}/train-*'
- config_name: '{''do_sample''=True, ''beams''=1, ''temperature''=1.0, ''top_k''=10000,
''top_p''=0.05}'
data_files:
- split: train
path: '{''do_sample''=True, ''beams''=1, ''temperature''=1.0, ''top_k''=10000,
''top_p''=0.05}/train-*'
- config_name: '{''do_sample''=True, ''beams''=1, ''temperature''=1.0, ''top_k''=10000,
''top_p''=0.1}'
data_files:
- split: train
path: '{''do_sample''=True, ''beams''=1, ''temperature''=1.0, ''top_k''=10000,
''top_p''=0.1}/train-*'
- config_name: '{''do_sample''=True, ''beams''=1, ''temperature''=1.0, ''top_k''=10000,
''top_p''=0.2}'
data_files:
- split: train
path: '{''do_sample''=True, ''beams''=1, ''temperature''=1.0, ''top_k''=10000,
''top_p''=0.2}/train-*'
---
# Dataset Card for "llama2_7b_bf16-winogrande-results"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 7,112 | [
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-0.02050... |
passionMan/usda_tokenized_source | 2023-10-30T04:56:51.000Z | [
"region:us"
] | passionMan | null | null | 0 | 4 | 2023-10-30T04:56:45 | ---
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
- split: test
path: data/test-*
dataset_info:
features:
- name: text
dtype: string
- name: label
dtype: int64
- name: input_ids
sequence: int32
- name: attention_mask
sequence: int8
splits:
- name: train
num_bytes: 1314644
num_examples: 5628
- name: test
num_bytes: 437798
num_examples: 1876
download_size: 434891
dataset_size: 1752442
---
# Dataset Card for "usda_tokenized_source"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 663 | [
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sankettgorey/layouts_donut_1 | 2023-10-30T06:00:49.000Z | [
"region:us"
] | sankettgorey | null | null | 0 | 4 | 2023-10-30T05:59:54 | ---
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
- split: test
path: data/test-*
- split: validation
path: data/validation-*
dataset_info:
features:
- name: image
dtype: image
- name: ground_truth
dtype: string
splits:
- name: train
num_bytes: 1107628464.82414
num_examples: 4007
- name: test
num_bytes: 136074844.03892994
num_examples: 501
- name: validation
num_bytes: 139076925.03892994
num_examples: 501
download_size: 1146273186
dataset_size: 1382780233.902
---
# Dataset Card for "layouts_donut_1"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 739 | [
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FelixChao/chemistry_zh-tw | 2023-10-30T11:16:38.000Z | [
"region:us"
] | FelixChao | null | null | 0 | 4 | 2023-10-30T11:16:33 | ---
dataset_info:
features:
- name: chem_text
dtype: string
splits:
- name: train
num_bytes: 70334276
num_examples: 40000
download_size: 33515185
dataset_size: 70334276
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
---
# Dataset Card for "chemistry_zh-tw"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 452 | [
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kheopsai/misendemeure | 2023-10-30T16:10:22.000Z | [
"region:us"
] | kheopsai | null | null | 0 | 4 | 2023-10-30T16:09:14 | Entry not found | 15 | [
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0.0379... |
nespc/cnn_dailymail_prompts_10pct | 2023-10-30T20:00:36.000Z | [
"region:us"
] | nespc | null | null | 0 | 4 | 2023-10-30T20:00:25 | ---
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
- split: test
path: data/test-*
dataset_info:
features:
- name: text
dtype: string
splits:
- name: train
num_bytes: 121034271
num_examples: 28711
- name: test
num_bytes: 4893023
num_examples: 1149
download_size: 70789900
dataset_size: 125927294
---
# Dataset Card for "cnn_dailymail_prompts_10pct"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 560 | [
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li-ping/all_pdf_dataset_1031_416data_v1 | 2023-10-30T21:05:03.000Z | [
"region:us"
] | li-ping | null | null | 0 | 4 | 2023-10-30T21:04:58 | ---
dataset_info:
features:
- name: set
struct:
- name: neg
sequence: string
- name: pos
sequence: string
- name: query
dtype: string
splits:
- name: train
num_bytes: 9010953
num_examples: 3163
download_size: 885584
dataset_size: 9010953
---
# Dataset Card for "all_pdf_dataset_1031_416data_v1"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 481 | [
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0... |
dwadden/covidfact_entailment | 2023-10-31T00:33:56.000Z | [
"task_categories:text-classification",
"task_ids:fact-checking",
"annotations_creators:expert-generated",
"language_creators:found",
"multilinguality:monolingual",
"size_categories:1K<n<10K",
"source_datasets:original",
"language:en",
"license:cc-by-nc-2.0",
"region:us"
] | dwadden | COVID-FACT is a dataset of claims about COVID-19. For this version of the dataset, we follow the preprocessing from the MultiVerS modeling paper https://github.com/dwadden/multivers, verifying claims against abstracts of scientific research articles. Entailment labels and rationales are included. | @article{Saakyan2021COVIDFactFE,
title={COVID-Fact: Fact Extraction and Verification of Real-World Claims on COVID-19 Pandemic},
author={Arkadiy Saakyan and Tuhin Chakrabarty and Smaranda Muresan},
journal={ArXiv},
year={2021},
volume={abs/2106.03794},
url={https://api.semanticscholar.org/CorpusID:235364036}
} | 0 | 4 | 2023-10-30T22:26:59 | ---
annotations_creators:
- expert-generated
language_creators:
- found
language:
- en
license:
- cc-by-nc-2.0
multilinguality:
- monolingual
size_categories:
- 1K<n<10K
source_datasets:
- original
task_categories:
- text-classification
task_ids:
- fact-checking
pretty_name: CovidFact
dataset_info:
features:
- name: claim_id
dtype: int32
- name: claim
dtype: string
- name: abstract_id
dtype: int32
- name: title
dtype: string
- name: abstract
sequence: string
- name: verdict
dtype: string
- name: evidence
sequence: int32
splits:
- name: train
num_bytes: 1547185
num_examples: 940
- name: test
num_bytes: 523542
num_examples: 317
download_size: 3610222
dataset_size: 2070727
---
# Dataset Card for "covidfact_entailment"
## Table of Contents
- [Dataset Description](#dataset-description)
- [Dataset Summary](#dataset-summary)
- [Dataset Structure](#dataset-structure)
- [Data Fields](#data-fields)
## Dataset Description
- **Repository:** <https://github.com/asaakyan/covidfact>
- **Point of Contact:** [David Wadden](mailto:davidw@allenai.org)
### Dataset Summary
COVID-FACT is a dataset of claims about COVID-19. For this version of the dataset, we follow the preprocessing from the MultiVerS modeling paper https://github.com/dwadden/multivers, verifying claims against abstracts of scientific research articles. Entailment labels and rationales are included.
## Dataset Structure
### Data fields
- `claim_id`: An `int32` claim identifier.
- `claim`: A `string`.
- `abstract_id`: An `int32` abstract identifier.
- `title`: A `string`.
- `abstract`: A list of `strings`, one for each sentence in the abstract.
- `verdict`: The fact-checking verdict, a `string`.
- `evidence`: A list of sentences from the abstract which provide evidence for the verdict.
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... |
slone/nllb-200-10M-sample | 2023-10-31T00:37:02.000Z | [
"task_categories:translation",
"size_categories:1M<n<10M",
"language:ak",
"language:am",
"language:ar",
"language:awa",
"language:azj",
"language:bm",
"language:ban",
"language:be",
"language:bem",
"language:bn",
"language:bho",
"language:bjn",
"language:bug",
"language:bg",
"languag... | slone | null | null | 0 | 4 | 2023-10-30T23:43:49 | ---
dataset_info:
features:
- name: laser_score
dtype: float64
- name: lang1
dtype: string
- name: text1
dtype: string
- name: lang2
dtype: string
- name: text2
dtype: string
- name: blaser_sim
dtype: float64
splits:
- name: train
num_bytes: 2279333006.0
num_examples: 9983398
download_size: 1825697094
dataset_size: 2279333006.0
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
license: odc-by
task_categories:
- translation
pretty_name: nllb-200-10M-sample
size_categories:
- 1M<n<10M
language:
- ak # aka_Latn Akan
- am # amh_Ethi Amharic
- ar # arb_Arab Modern Standard Arabic
- awa # awa_Deva Awadhi
- azj # azj_Latn North Azerbaijani
- bm # bam_Latn Bambara
- ban # ban_Latn Balinese
- be # bel_Cyrl Belarusian
- bem # bem_Latn Bemba
- bn # ben_Beng Bengali
- bho # bho_Deva Bhojpuri
- bjn # bjn_Latn Banjar (Latin script)
- bug # bug_Latn Buginese
- bg # bul_Cyrl Bulgarian
- ca # cat_Latn Catalan
- ceb # ceb_Latn Cebuano
- cs # ces_Latn Czech
- cjk # cjk_Latn Chokwe
- ckb # ckb_Arab Central Kurdish
- crh # crh_Latn Crimean Tatar
- da # dan_Latn Danish
- de # deu_Latn German
- dik # dik_Latn Southwestern Dinka
- dyu # dyu_Latn Dyula
- el # ell_Grek Greek
- en # eng_Latn English
- eo # epo_Latn Esperanto
- et # est_Latn Estonian
- ee # ewe_Latn Ewe
- fo # fao_Latn Faroese
- fj # fij_Latn Fijian
- fi # fin_Latn Finnish
- fon # fon_Latn Fon
- fr # fra_Latn French
- fur # fur_Latn Friulian
- ff # fuv_Latn Nigerian Fulfulde
- gaz # gaz_Latn West Central Oromo
- gd # gla_Latn Scottish Gaelic
- ga # gle_Latn Irish
- gl # glg_Latn Galician
- gn # grn_Latn Guarani
- gu # guj_Gujr Gujarati
- ht # hat_Latn Haitian Creole
- ha # hau_Latn Hausa
- he # heb_Hebr Hebrew
- hi # hin_Deva Hindi
- hne # hne_Deva Chhattisgarhi
- hr # hrv_Latn Croatian
- hu # hun_Latn Hungarian
- hy # hye_Armn Armenian
- ig # ibo_Latn Igbo
- ilo # ilo_Latn Ilocano
- id # ind_Latn Indonesian
- is # isl_Latn Icelandic
- it # ita_Latn Italian
- jv # jav_Latn Javanese
- ja # jpn_Jpan Japanese
- kab # kab_Latn Kabyle
- kac # kac_Latn Jingpho
- kam # kam_Latn Kamba
- kn # kan_Knda Kannada
- ks # kas_Arab Kashmiri (Arabic script)
- ks # kas_Deva Kashmiri (Devanagari script)
- ka # kat_Geor Georgian
- kk # kaz_Cyrl Kazakh
- kbp # kbp_Latn Kabiyè
- kea # kea_Latn Kabuverdianu
- mn # khk_Cyrl Halh Mongolian
- km # khm_Khmr Khmer
- ki # kik_Latn Kikuyu
- rw # kin_Latn Kinyarwanda
- ky # kir_Cyrl Kyrgyz
- kmb # kmb_Latn Kimbundu
- kmr # kmr_Latn Northern Kurdish
- kr # knc_Arab Central Kanuri (Arabic script)
- kr # knc_Latn Central Kanuri (Latin script)
- kg # kon_Latn Kikongo
- ko # kor_Hang Korean
- lo # lao_Laoo Lao
- lij # lij_Latn Ligurian
- li # lim_Latn Limburgish
- ln # lin_Latn Lingala
- lt # lit_Latn Lithuanian
- lmo # lmo_Latn Lombard
- ltg # ltg_Latn Latgalian
- lb # ltz_Latn Luxembourgish
- lua # lua_Latn Luba-Kasai
- lg # lug_Latn Ganda
- luo # luo_Latn Luo
- lus # lus_Latn Mizo
- lv # lvs_Latn Standard Latvian
- mag # mag_Deva Magahi
- mai # mai_Deva Maithili
- ml # mal_Mlym Malayalam
- mr # mar_Deva Marathi
- min # min_Latn Minangkabau (Latin script)
- mk # mkd_Cyrl Macedonian
- mt # mlt_Latn Maltese
- mni # mni_Beng Meitei (Bengali script)
- mos # mos_Latn Mossi
- mi # mri_Latn Maori
- my # mya_Mymr Burmese
- nl # nld_Latn Dutch
- nb # nob_Latn Norwegian Bokmål
- ne # npi_Deva Nepali
- nso # nso_Latn Northern Sotho
- nus # nus_Latn Nuer
- ny # nya_Latn Nyanja
- oc # oci_Latn Occitan
- ory # ory_Orya Odia
- pag # pag_Latn Pangasinan
- pa # pan_Guru Eastern Panjabi
- pap # pap_Latn Papiamento
- pbt # pbt_Arab Southern Pashto
- fa # pes_Arab Western Persian
- plt # plt_Latn Plateau Malagasy
- pl # pol_Latn Polish
- pt # por_Latn Portuguese
- prs # prs_Arab Dari
- qu # quy_Latn Ayacucho Quechua
- ro # ron_Latn Romanian
- rn # run_Latn Rundi
- ru # rus_Cyrl Russian
- sg # sag_Latn Sango
- sa # san_Deva Sanskrit
- sat # sat_Beng ?
- scn # scn_Latn Sicilian
- shn # shn_Mymr Shan
- si # sin_Sinh Sinhala
- sk # slk_Latn Slovak
- sl # slv_Latn Slovenian
- sm # smo_Latn Samoan
- sn # sna_Latn Shona
- sd # snd_Arab Sindhi
- so # som_Latn Somali
- st # sot_Latn Southern Sotho
- es # spa_Latn Spanish
- sc # srd_Latn Sardinian
- sr # srp_Cyrl Serbian
- ss # ssw_Latn Swati
- su # sun_Latn Sundanese
- sv # swe_Latn Swedish
- sw # swh_Latn Swahili
- szl # szl_Latn Silesian
- ta # tam_Taml Tamil
- taq # taq_Latn Tamasheq (Latin script)
- tt # tat_Cyrl Tatar
- te # tel_Telu Telugu
- tg # tgk_Cyrl Tajik
- tl # tgl_Latn Tagalog
- ti # tir_Ethi Tigrinya
- tpi # tpi_Latn Tok Pisin
- tn # tsn_Latn Tswana
- ts # tso_Latn Tsonga
- tk # tuk_Latn Turkmen
- tum # tum_Latn Tumbuka
- tr # tur_Latn Turkish
- tw # twi_Latn Twi
- tzm # tzm_Tfng Central Atlas Tamazight
- ug # uig_Arab Uyghur
- uk # ukr_Cyrl Ukrainian
- umb # umb_Latn Umbundu
- ur # urd_Arab Urdu
- uz # uzn_Latn Northern Uzbek
- vec # vec_Latn Venetian
- vi # vie_Latn Vietnamese
- war # war_Latn Waray
- wo # wol_Latn Wolof
- xh # xho_Latn Xhosa
- yi # ydd_Hebr Eastern Yiddish
- yo # yor_Latn Yoruba
- zh # zho_Hans Chinese (Simplified)
- zh # zho_Hant Chinese (Traditional)
- ms # zsm_Latn Standard Malay
- zu # zul_Latn Zulu
---
# Dataset Card for "nllb-200-10M-sample"
This is a sample of nearly 10M sentence pairs from the [NLLB-200](https://arxiv.org/abs/2207.04672)
mined dataset [allenai/nllb](https://huggingface.co/datasets/allenai/nllb),
scored with the model [facebook/blaser-2.0-qe](https://huggingface.co/facebook/blaser-2.0-qe)
described in the [SeamlessM4T](https://arxiv.org/abs/2308.11596) paper.
The sample is not random; instead, we just took the top `n` language pairs from each translation direction.
The number `n` was computed with the goal of upsamping the directions that contain underrepresented languages.
Nevertheless, the 187 languoids (language and script combinations) are not represented equally,
with most languoids totaling 36K to 200K sentences.
Over 60% of the sentence pairs have BLASER-QE score above 3.5.
This dataset can be used for fine-tuning massively multilingual translation models.
We suggest the following scenario:
- Filter the dataset by the value of `blaser_sim` (the recommended threshold is 3.0 or 3.5);
- Randomly swapping the source/target roles in the sentence pairs during data loading;
- Use that data to augment the dataset while fine-tuning an NLLB-like model for a new translation direction,
in order to mitigate forgetting of all the other translation directions.
The dataset is released under the terms of [ODC-BY](https://opendatacommons.org/licenses/by/1-0/).
By using this, you are also bound to the respective Terms of Use and License of the original source.
Citation:
- NLLB Team et al, No Language Left Behind: Scaling Human-Centered Machine Translation, Arxiv https://arxiv.org/abs/2207.04672, 2022.
- Seamless Communication et al, SeamlessM4T — Massively Multilingual & Multimodal Machine Translation, Arxiv https://arxiv.org/abs/2308.11596, 2023.
The following language codes are supported. The mapping between languages and codes can be found in the [NLLB-200 paper](https://arxiv.org/abs/2207.04672)
or in the [FLORES-200 repository](https://github.com/facebookresearch/flores/blob/main/flores200/README.md#languages-in-flores-200).
```
aka_Latn amh_Ethi arb_Arab awa_Deva azj_Latn bam_Latn ban_Latn bel_Cyrl bem_Latn ben_Beng bho_Deva bjn_Latn
bug_Latn bul_Cyrl cat_Latn ceb_Latn ces_Latn cjk_Latn ckb_Arab crh_Latn dan_Latn deu_Latn dik_Latn dyu_Latn
ell_Grek eng_Latn epo_Latn est_Latn ewe_Latn fao_Latn fij_Latn fin_Latn fon_Latn fra_Latn fur_Latn fuv_Latn
gaz_Latn gla_Latn gle_Latn glg_Latn grn_Latn guj_Gujr hat_Latn hau_Latn heb_Hebr hin_Deva hne_Deva hrv_Latn
hun_Latn hye_Armn ibo_Latn ilo_Latn ind_Latn isl_Latn ita_Latn jav_Latn jpn_Jpan kab_Latn kac_Latn kam_Latn
kan_Knda kas_Arab kas_Deva kat_Geor kaz_Cyrl kbp_Latn kea_Latn khk_Cyrl khm_Khmr kik_Latn kin_Latn kir_Cyrl
kmb_Latn kmr_Latn knc_Arab knc_Latn kon_Latn kor_Hang lao_Laoo lij_Latn lim_Latn lin_Latn lit_Latn lmo_Latn
ltg_Latn ltz_Latn lua_Latn lug_Latn luo_Latn lus_Latn lvs_Latn mag_Deva mai_Deva mal_Mlym mar_Deva min_Latn
mkd_Cyrl mlt_Latn mni_Beng mos_Latn mri_Latn mya_Mymr nld_Latn nob_Latn npi_Deva nso_Latn nus_Latn nya_Latn
oci_Latn ory_Orya pag_Latn pan_Guru pap_Latn pbt_Arab pes_Arab plt_Latn pol_Latn por_Latn prs_Arab quy_Latn
ron_Latn run_Latn rus_Cyrl sag_Latn san_Deva sat_Beng scn_Latn shn_Mymr sin_Sinh slk_Latn slv_Latn smo_Latn
sna_Latn snd_Arab som_Latn sot_Latn spa_Latn srd_Latn srp_Cyrl ssw_Latn sun_Latn swe_Latn swh_Latn szl_Latn
tam_Taml taq_Latn tat_Cyrl tel_Telu tgk_Cyrl tgl_Latn tir_Ethi tpi_Latn tsn_Latn tso_Latn tuk_Latn tum_Latn
tur_Latn twi_Latn tzm_Tfng uig_Arab ukr_Cyrl umb_Latn urd_Arab uzn_Latn vec_Latn vie_Latn war_Latn wol_Latn
xho_Latn ydd_Hebr yor_Latn zho_Hans zho_Hant zsm_Latn zul_Latn
```
| 9,519 | [
[
-0.0457763671875,
-0.03607177734375,
0.01873779296875,
0.024017333984375,
-0.00714111328125,
0.00946807861328125,
-0.01255035400390625,
-0.031890869140625,
0.0406494140625,
0.03961181640625,
-0.04119873046875,
-0.04541015625,
-0.0369873046875,
0.015213012695... |
tyzhu/find_last_sent_train_30_eval_10_sentbefore | 2023-10-31T14:58:14.000Z | [
"region:us"
] | tyzhu | null | null | 0 | 4 | 2023-10-31T03:32:35 | ---
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
- split: validation
path: data/validation-*
dataset_info:
features:
- name: inputs
dtype: string
- name: targets
dtype: string
- name: title
dtype: string
- name: context
dtype: string
splits:
- name: train
num_bytes: 150074
num_examples: 110
- name: validation
num_bytes: 10769
num_examples: 10
download_size: 83382
dataset_size: 160843
---
# Dataset Card for "find_last_sent_train_30_eval_10_sentbefore"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards) | 686 | [
[
-0.03094482421875,
-0.012237548828125,
0.031982421875,
0.0308990478515625,
-0.0018787384033203125,
0.0009541511535644531,
0.010498046875,
0.0173187255859375,
0.0472412109375,
0.0338134765625,
-0.059295654296875,
-0.048797607421875,
-0.029449462890625,
-0.008... |
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