Free energy along drug-protein binding pathways interactively sampled in virtual reality

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Authors: H.M. Deeks, K. Zinovjev, J. Barnoud, A.J. Mulholland, M.W. van der Kamp, D.R. Glowacki

Journal title: Nature Scientific Reports

Journal publisher: Nature Publishing Group

Published year: 2023

DOI identifier: 10.48550/arxiv.2311.17925

ISSN: 2045-2322