Datasets:
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README.md
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features:
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- name: smiles
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dtype: string
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- name: chembl_id
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dtype: string
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- name: labels
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sequence: int64
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- name: mask
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sequence: int64
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splits:
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- name: train
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num_bytes:
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num_examples: 350183
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- name: test
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num_bytes:
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num_examples: 87546
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download_size:
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dataset_size:
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configs:
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- config_name: default
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data_files:
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features:
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- name: smiles
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dtype: string
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- name: labels
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sequence: int64
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- name: mask
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sequence: int64
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- name: MW
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dtype: float64
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- name: LogP
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dtype: float64
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- name: TPSA
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dtype: float64
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- name: Complexity
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dtype: float64
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splits:
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- name: train
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num_bytes: 1605736737.3156543
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num_examples: 350183
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- name: test
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num_bytes: 401435330.6843458
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num_examples: 87546
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download_size: 31528613
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dataset_size: 2007172068.0
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configs:
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- config_name: default
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data_files:
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data/test-00000-of-00001.parquet
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data/train-00000-of-00004.parquet
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data/train-00001-of-00004.parquet
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data/train-00002-of-00004.parquet
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data/train-00003-of-00004.parquet
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size 6303105
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