Accurate determination of protein:ligand standard binding free energies from molecular dynamics simulations
利用分子动力学模拟精确测定蛋白质：配体标准结合自由能
期刊:Nature Protocols
影响因子:16
doi:10.1038/s41596-021-00676-1
Fu, Haohao; Chen, Haochuan; Blazhynska, Marharyta; Goulard Coderc de Lacam, Emma; Szczepaniak, Florence; Pavlova, Anna; Shao, Xueguang; Gumbart, James C; Dehez, François; Roux, Benoît; Cai, Wensheng; Chipot, Christophe
