A Robust Force Field Based Method for Calculating Conformational Energies of Charged Drug-Like Molecules
Author:
Affiliation:
1. Department of Medicinal Chemistry, Faculty of Pharmaceutical Sciences, University of Copenhagen, Universitetsparken 2, 2100 Copenhagen, Denmark
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/ci200345f
Reference35 articles.
1. Quantum Mechanical Conformational Analysis of β-Alanine Zwitterion in Aqueous Solution
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