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Editorial: Mechanisms, thermodynamics and kinetics of ligand binding revealed from molecular simulations and machine learning.

作者信息

Miao Yinglong, Chang Chia-En A, Zhu Weiliang, McCammon J Andrew

机构信息

Center for Computational Biology and Department of Molecular Biosciences, University of Kansas, Lawrence, KS, United States.

Department of Chemistry, University of California, Riverside, Riverside, CA, United States.

出版信息

Front Mol Biosci. 2023 Jan 17;10:1139471. doi: 10.3389/fmolb.2023.1139471. eCollection 2023.

Abstract
摘要

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