Real-World Assessment of Machine Learned Docking Using Bioassay-Derived Benchmarks
收藏DataCite Commons2026-05-04 更新2026-05-07 收录
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https://zenodo.org/doi/10.5281/zenodo.20030384
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资源简介:
LIT-PCBA receptors as prepared for use with DiffDock-Pocket from "Real-World Assessment of Machine Learned Docking Using Bioassay-Derived Benchmarks." Script to score DiffDock-Pocket generated poses with the Pafnucy scoring function. DUD-E receptors and ligands as prepared for use with CDOCKER from "Real-World Assessment of Machine Learned Docking Using Bioassay-Derived Benchmarks."
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Zenodo
创建时间:
2026-05-04



