Biomolecular Force Field Parameterization via Atoms-in-Molecule Electron Density Partitioning
Author:
Affiliation:
1. Department of Chemistry, Yale University, New Haven, Connecticut 06520-8107, United States
2. TCM Group, Cavendish Laboratory, 19 JJ Thomson Avenue, Cambridge CB3 0HE, United Kingdom
Funder
Engineering and Physical Sciences Research Council
Directorate-General for Research and Innovation
National Institute of General Medical Sciences
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.6b00027
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4. Comparison of multiple Amber force fields and development of improved protein backbone parameters
5. Recent developments and applications of the CHARMM force fields
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