遇见数据集

QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL2094119

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OpenML2016-07-16 更新2024-12-07 收录
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This dataset contains QSAR data (from ChEMBL version 17) showing activity values (unit is pseudo-pCI50) of several compounds on drug target ChEMBL_ID: CHEMBL2094119 (TID: 104701), and it has 392 rows and 102 features (not including molecule IDs and class feature: molecule_id and pXC50). The features represent FCFP 1024-bit Molecular Fingerprints which were generated from SMILES strings. Feature selection was applied to this dataset. The fingerprints were obtained using the Pipeline Pilot program

创建时间:
2016-07-16
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