metadata
dataset_info:
features:
- name: CID
dtype: int64
- name: smiles
dtype: string
splits:
- name: train
num_bytes: 372984
num_examples: 6743
download_size: 194005
dataset_size: 372984
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
Simeonov2008 Dataset
The Simeonov2008 Dataset contains fluorescence profiling data for over 70,000 compounds, evaluating their autofluorescence across multiple spectral windows commonly used in high-throughput screening (HTS). This dataset was published in the following paper.