遇见数据集

MotifLeadDB v1

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Zenodo2026-01-02 更新2026-05-26 收录
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MotifLeadDB contains 390,508 modeled receptor–ligand complex structures, organized hierarchically by protein receptor, ligand scaffold, and model confidence level. A total of 395 non-redundant protein receptors and 31,236 ligand scaffolds are included. Structural models are provided in three confidence levels (Level 1–3), defined by scaffold alignment accuracy and pharmacophore conservation. Within each level, models are grouped hierarchically by protein receptor and ligand scaffold, and distributed as separate archives. Detailed descriptions of all CSV columns and file organization are provided in the accompanying README.md.

提供机构:
Zenodo
创建时间:
2026-01-02
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