Showing results (181-190 of 484) with videos related to
Sort By:
Pageof 49
The Journal of Chemical Physics|November 4, 2017
Development of reactive force fields using ab initio molecular dynamics simulation minimally biased to experimental dataChen Chen, Christopher Arntsen, Gregory A VothBiophysical Journal|January 26, 2023
The role of conformational change and key glutamic acid residues in the ClC-ec1 antiporterZhi Yue, Chenghan Li, Gregory A VothJournal of Chemical Theory and Computation|September 25, 2020
Temperature and Phase Transferable Bottom-up Coarse-Grained ModelsJaehyeok Jin, Alvin Yu, Gregory A VothFaraday Discussions|March 20, 2014
Exploring the behaviour of the hydrated excess proton at hydrophobic interfacesRevati Kumar, Chris Knight, Gregory A VothThe Journal of Chemical Physics|June 15, 2023
Using classifiers to understand coarse-grained models and their fidelity with the underlying all-atom systemsAleksander E P Durumeric, Gregory A VothThe Journal of Chemical Physics|February 23, 2026
A bottom-up field-theoretic framework via hierarchical coarse-graining: Generalized mode theoryJaehyeok Jin, Yining Han, Gregory A VothNature Computational Science|July 1, 2026
Systematic bottom-up coarse-graining of hydrated excess proton transport across scalesJaehyeok Jin, Zhefu Li, Gregory A VothThe Journal of Physical Chemistry. B|December 2, 2022
Generalized Transition State Theory Treatment of Water-Assisted Proton Transport Processes in ProteinsYu Liu, Chenghan Li, Gregory A VothThe Journal of Chemical Physics|October 3, 2019
Adversarial-residual-coarse-graining: Applying machine learning theory to systematic molecular coarse-grainingAleksander E P Durumeric, Gregory A VothThe Journal of Physical Chemistry. B|August 4, 2006
Mixed atomistic and coarse-grained molecular dynamics: simulation of a membrane-bound ion channelQiang Shi, Sergei Izvekov, Gregory A VothPageof 49