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Fast, Accurate, and Reliable Protocols for Routine Calculations of Protein-Ligand Binding Affinities in Drug Design Projects Using AMBER GPU-TI with ff14SB/GAFF

Xibing He, Shuhan Liu, Tai Sung Lee, Beihong Ji, Viet H. Man, Darrin M. York, Junmei Wang

Research output: Contribution to journal › Article › peer-review

72 Scopus citations

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Engineering & Materials Science

Chemical Compounds