Macrocycle Cell Permeability Measured by Solvation Free Energies in Polar and Apolar Environments

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Authors: Anna S. Kamenik, Johannes Kraml, Florian Hofer, Franz Waibl, Patrick K. Quoika, Ursula Kahler, Michael Schauperl, Klaus R. Liedl

Journal title: Journal of Chemical Information and Modeling

Journal number: 60/7

Journal publisher: American Chemical Society

Published year: 2020

Published pages: 3508-3517

DOI identifier: 10.1021/acs.jcim.0c00280

ISSN: 1549-9596