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

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

JOURNAL=Frontiers in Molecular Biosciences

VOLUME=10

YEAR=2023

URL=https://www.frontiersin.org/journals/molecular-biosciences/articles/10.3389/fmolb.2023.1139471

DOI=10.3389/fmolb.2023.1139471

ISSN=2296-889X