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Best Practices for Constructing, Preparing, and Evaluating Protein-Ligand Binding Affinity Benchmarks

David F Hahn,Christopher I Bayly,Hannah E Bruce Macdonald,John D Chodera,Antonia S J S Mey,David L Mobley,Laura Perez Benito,Christina E M Schindler,Gary Tresadern,Gregory L Warren

Living Journal of Computational Molecular Science（2022）

引用 6|浏览12
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