
The Chong Lab
@ChongLabPitt
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Molecular Biophysics Lab at the University of Pittsburgh - Molecular Dynamics Simulations; Weighted Ensemble Strategy; Force Field Development
Pittsburgh, PA
Joined January 2019
RT @jctc_papers: [ASAP] Adaptive Partitioning QM/MM for Molecular Dynamics Simulations: 6. Proton Transport through a Biological Channel ht….
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Protein–protein binding pathways and calculations of rate constants using fully-continuous, explicit-solvent simulations - Chemical Science (RSC Publishing)
pubs.rsc.org
A grand challenge in the field of biophysics has been the complete characterization of protein–protein binding processes at atomic resolution. This characterization requires the direct simulation of...
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