Quantum mechanics/molecular mechanics dual Hamiltonian free energy perturbation
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.4817402
Reference52 articles.
1. Monte Carlo free energy estimates using non-Boltzmann sampling: Application to the sub-critical Lennard-Jones fluid
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3. High‐Temperature Equation of State by a Perturbation Method. I. Nonpolar Gases
4. QM/MM Methods for Biomolecular Systems
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