BioLiP2-Opt Dataset
收藏Figshare2025-02-15 更新2026-04-08 收录
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https://figshare.com/articles/dataset/BioLiP2-Opt_Dataset/27430305/1
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资源简介：
BioLiP2-Opt, a protein-ligand binding dataset that contains 3000+ unique PDB entries with binding affinity annotations, 5600+ protein-ligand complexes structures optimized by PDBBind-Opt workflow.biolip2_opt.tar.gz: Protein-Ligand complexes structures in BioLiP2-Optbiolip2_opt_metadata.csv: Metadata for this dataset, including year, resolution, binding affinity annotationsREADME.md: Description of the structural dataset and columns in the metadata csv file
提供机构：
Sun, Kunyang; Li, Jie; Wang, Yingze; Head-Gordon, Teresa; Guan, Xingyi; Zhang, Oufan
创建时间：
2024-11-01
