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The Journal of Physical Chemistry Letters|August 22, 2015
Infrared Spectrum of the Hydrated Proton in WaterJianqing Xu, Yong Zhang, Gregory A VothThe Journal of Chemical Physics|February 28, 2021
Constructing many-body dissipative particle dynamics models of fluids from bottom-up coarse-grainingYining Han, Jaehyeok Jin, Gregory A VothJournal of Chemical Theory and Computation|November 13, 2023
K-Means Clustering Coarse-Graining (KMC-CG): A Next Generation Methodology for Determining Optimal Coarse-Grained Mappings of Large BiomoleculesJiangbo Wu, Weizhi Xue, Gregory A VothThe Journal of Physical Chemistry. B|July 21, 2006
Systematic coarse-graining of nanoparticle interactions in molecular dynamics simulationSergei Izvekov, Angela Violi, Gregory A VothThe Journal of Physical Chemistry. B|July 3, 2010
Structure and dynamics of concentrated hydrochloric acid solutionsJianqing Xu, Sergei Izvekov, Gregory A VothThe Journal of Physical Chemistry. B|April 21, 2023
Acidic Conditions Impact Hydrophobe Transfer across the Oil-Water Interface in Unusual WaysSijia Chen, Zhefu Li, Gregory A VothThe Journal of Physical Chemistry. A|July 11, 2024
Reaction Pathway Analysis of PET Deconstruction via Methanolysis and Tertiary Amine CatalystsRishabh Sanghavi, Nadia N Intan, Shaoqu Xie, et al.The Journal of Physical Chemistry. B|August 17, 2018
Inhibition of the Exoglucanase Cel7A by a Douglas-Fir-Condensed TanninKarl R Oleson, Kayla G Sprenger, Jim Pfaendtner, et al.The Journal of Physical Chemistry. B|July 25, 2015
Trp-Cage Folding on Organic SurfacesZachary A Levine, Sean A Fischer, Joan-Emma Shea, et al.The Journal of Chemical Physics|December 23, 2024
A modular and extensible CHARMM-compatible model for all-atom simulation of polypeptoidsAlex Berlaga, Kaylyn Torkelson, Aniruddha Seal, et al.Pageof 60