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--- |
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dataset_info: |
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features: |
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- name: SMILES |
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dtype: string |
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splits: |
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- name: train |
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num_bytes: 55395757775 |
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num_examples: 1006284132 |
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download_size: 16599203725 |
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dataset_size: 55395757775 |
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configs: |
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- config_name: default |
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data_files: |
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- split: train |
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path: data/train-* |
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--- |
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# ZINC20 Dataset filtered from [ZINC20](https://huggingface.co/datasets/xchen16/zinc20) |
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This dataset contains molecules from the ZINC20 database, with the following filtering criteria applied: |
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- All molecules include hydrogen atoms. |
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- Disconnected fragments have been removed. |
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- Only molecules with more than 100 atoms have been retained. |
