Upload dataset

README.md

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 ---
 license: apache-2.0
+dataset_info:
+  features:
+  - name: smiles
+    dtype: string
+  - name: activity
+    dtype: float64
+  splits:
+  - name: train
+    num_bytes: 13736
+    num_examples: 513
+  - name: validation
+    num_bytes: 1721
+    num_examples: 64
+  - name: test
+    num_bytes: 1780
+    num_examples: 65
+  download_size: 15823
+  dataset_size: 17237
+configs:
+- config_name: default
+  data_files:
+  - split: train
+    path: data/train-*
+  - split: validation
+    path: data/validation-*
+  - split: test
+    path: data/test-*
 ---
 The dataset is created using data from the deepchem library introduced by moleculenet. The dataset is split in a random fashion and normalized using z_score. The random seed used for splitting is 123.

data/test-00000-of-00001.parquet

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+size 2697

data/train-00000-of-00001.parquet

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+size 10466

data/validation-00000-of-00001.parquet

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+size 2660