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juppy44/tox21-ai-descriptions

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Hugging Face2026-03-23 更新2026-03-29 收录
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--- dataset_info: features: - name: ID dtype: string - name: smiles dtype: string - name: inchikey dtype: string - name: sdftitle dtype: string - name: order dtype: int64 - name: set dtype: string - name: CVfold dtype: float64 - name: NR-AhR dtype: float64 - name: NR-AR dtype: float64 - name: NR-AR-LBD dtype: float64 - name: NR-Aromatase dtype: float64 - name: NR-ER dtype: float64 - name: NR-ER-LBD dtype: float64 - name: NR-PPAR-gamma dtype: float64 - name: SR-ARE dtype: float64 - name: SR-ATAD5 dtype: float64 - name: SR-HSE dtype: float64 - name: SR-MMP dtype: float64 - name: SR-p53 dtype: float64 - name: description dtype: large_string splits: - name: train num_bytes: 4250995 num_examples: 11764 - name: validation num_bytes: 75096 num_examples: 296 download_size: 1470509 dataset_size: 4326091 configs: - config_name: default data_files: - split: train path: data/train-* - split: validation path: data/validation-* ---

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