A Comparison of Quantum and Molecular Mechanical Methods to Estimate Strain Energy in Druglike Fragments
Author:
Affiliation:
1. Department of Discovery Chemistry, Genentech, Inc., 1 DNA Way, South San Francisco, California 94080, United States
Funder
Genentech
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.6b00614
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