Datasets:
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README.md
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num_examples: 12728449
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download_size: 5293486933
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dataset_size: 15467486944
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- config_name: default
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features:
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- name: SMILES
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dtype: string
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- name: PUBCHEM_CID
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dtype: int64
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- name: split
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dtype: string
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- name: AID
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dtype: string
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- name: Y
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dtype: int64
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splits:
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- name: train
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num_bytes: 12634275804
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num_examples: 138547273
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- name: test
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num_bytes: 1578698654
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num_examples: 17069726
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- name: validation
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num_bytes: 1254512486
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num_examples: 12728449
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download_size: 5293486933
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dataset_size: 15467486944
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configs:
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- config_name: MolData
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data_files:
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num_examples: 12728449
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download_size: 5293486933
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dataset_size: 15467486944
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configs:
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- config_name: MolData
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data_files:
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