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The Journal of Chemical Physics|October 15, 2005
Multiscale coarse graining of liquid-state systemsSergei Izvekov, Gregory A VothThe Journal of Chemical Physics|January 19, 2010
A quantitative assessment of the accuracy of centroid molecular dynamics for the calculation of the infrared spectrum of liquid waterFrancesco Paesani, Gregory A VothJournal of Chemical Theory and Computation|December 8, 2015
Superposition State Molecular DynamicsArun Venkatnathan, Gregory A VothJournal of Chemical Theory and Computation|February 27, 2018
Ultra-Coarse-Grained Models Allow for an Accurate and Transferable Treatment of Interfacial SystemsJaehyeok Jin, Gregory A VothThe Journal of Chemical Physics|November 26, 2008
Nonlinear quantum time correlation functions from centroid molecular dynamics and the maximum entropy methodFrancesco Paesani, Gregory A VothThe Journal of Chemical Physics|April 26, 2005
A linear-scaling self-consistent generalization of the multistate empirical valence bond method for multiple excess protons in aqueous systemsFeng Wang, Gregory A VothThe Journal of Chemical Physics|July 16, 2024
Understanding dynamics in coarse-grained models. IV. Connection of fine-grained and coarse-grained dynamics with the Stokes-Einstein and Stokes-Einstein-Debye relationsJaehyeok Jin, Gregory A VothBiochimica Et Biophysica Acta|December 20, 2011
Expanding the view of proton pumping in cytochrome c oxidase through computer simulationYuxing Peng, Gregory A VothBiophysical Journal|November 22, 2011
The coupled proton transport in the ClC-ec1 Cl(-)/H(+) antiporterYong Zhang, Gregory A VothJournal of Chemical Theory and Computation|January 4, 2022
Using Machine Learning to Greatly Accelerate Path Integral <i>Ab Initio</i> Molecular DynamicsChenghan Li, Gregory A VothPageof 49