Getting the Right Answers for the Right Reasons: Toward Predictive Molecular Simulations of Water with Many-Body Potential Energy Functions
Author:
Affiliation:
1. Department of Chemistry and Biochemistry, University of California—San Diego, La Jolla, California 92093, United States
Funder
Division of Chemistry
Publisher
American Chemical Society (ACS)
Subject
General Medicine,General Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.accounts.6b00285
Reference60 articles.
1. Molecular Dynamics Study of Liquid Water
2. Simulating water with rigid non-polarizable models: a general perspective
3. A reappraisal of what we have learnt during three decades of computer simulations on water
4. Atomistic water models: Aqueous thermodynamic properties from ambient to supercritical conditions
5. Modeling Molecular Interactions in Water: From Pairwise to Many-Body Potential Energy Functions
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