Performance of the AMBER94, MMFF94, and OPLS-AA Force Fields for Modeling Organic Liquids
Author:
Affiliation:
1. Department of Chemistry, Yale University, New Haven, Connecticut 06520-8107
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,General Engineering
Link
https://pubs.acs.org/doi/pdf/10.1021/jp9624257
Reference26 articles.
1. Free energy calculations: a breakthrough for modeling organic chemistry in solution
2. Free energy calculations: Applications to chemical and biochemical phenomena
3. Molecular dynamics of proteins with the OPLS potential functions. Simulation of the third domain of silver pheasant ovomucoid in water
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