遇见数据集

Drug-target residence time data

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Zenodo2021-11-05 更新2026-05-25 收录
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资源简介:

Drug-target residence time data:<br> - PDBrt drug-target residence time data.xlsx contains information about target residence time and other binding kinetics coefficients, basic ligand properties like simplified molecular-input line-entry system (SMILES) or International Chemical Identifier (InChI) string, as well as the reference literature in PubMed - PDBrt drug-target structure files.zip contains structure files: the protein molecule along with other components such as water molecules and metal ions in the <em>pdb</em> format, while the ligand (drug) in Structure Data Format (<em>sdf</em>)

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Zenodo
创建时间:
2021-11-05
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