Predictions from First-Principles of Membrane Permeability to Small Molecules: How Useful Are They in Practice?-Reference-Cited by-同舟云学术

Predictions from First-Principles of Membrane Permeability to Small Molecules: How Useful Are They in Practice?

Published:2023-07-14 Issue:15 Volume:63 Page:4533-4544
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Chipot Christophe¹²³^ORCID

Affiliation:

1. Laboratoire International Associé Centre National de la Recherche Scientifique et University of Illinois at Urbana−Champaign, Unité Mixte de Recherche n◦7019, Université de Lorraine, 54500 Vandœuvre-lès-Nancy cedex, France

2. Beckman Institute for Advanced Science and Technology, and Department of Physics, University of Illinois at Urbana−Champaign, Urbana, Illinois 61820, United States

3. Department of Biochemistry and Molecular Biology, University of Chicago, Chicago, Illinois 60637, United States

Funder

Agence Nationale de la Recherche

France Chicago Center

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.3c00686

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1. Estimation of clinical trial success rates and related parameters