On the Interfragment Exchange in the X-Pol Method
Author:
Affiliation:
1. Department of Chemistry and Minnesota Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota 55455
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/ct100268p
Reference53 articles.
1. Design of a Next Generation Force Field: The X-POL Potential
2. Toward a Molecular Orbital Derived Empirical Potential for Liquid Simulations
3. A molecular-orbital derived polarization potential for liquid water
4. Hydrogen fluoride phase behavior and molecular structure: A QM/MM potential model approach
5. X-Pol Potential: An Electronic Structure-Based Force Field for Molecular Dynamics Simulation of a Solvated Protein in Water
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