Predicting the mutation effects of protein-ligand interactions via end-point binding free energy calculations: strategies and analyses - researchr publication

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Yang Yu, Zhe Wang, Lingling Wang, sheng Tian, Tingjun Hou, Huiyong Sun. Predicting the mutation effects of protein-ligand interactions via end-point binding free energy calculations: strategies and analyses. J. Cheminformatics, 14(1):56, 2022. [doi]

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