Free-Energy Profiles for Membrane Permeation of Compounds Calculated Using Rare-Event Sampling Methods
Author:
Affiliation:
1. Center for Computational Sciences, University of Tsukuba, 1-1-1 Tennodai, Tsukuba, Ibaraki305-8577, Japan
Funder
Sumitomo Foundation
Japan Society for the Promotion of Science
Publisher
American Chemical Society (ACS)
Subject
Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.2c01097
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1. Cell-penetrating peptides
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