TIES 2.0: A Dual-Topology Open Source Relative Binding Free Energy Builder with Web Portal

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Authors: Mateusz K. Bieniek, Alexander D. Wade, Agastya P. Bhati, Shunzhou Wan, Peter V. Coveney

Journal title: Journal of Chemical Information and Modeling

Journal number: 63

Journal publisher: American Chemical Society

Published year: 2023

Published pages: 718-724

DOI identifier: 10.1021/acs.jcim.2c01596

ISSN: 1549-9596