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Biochimica Et Biophysica Acta|January 7, 2015
Molecular basis of endosomal-membrane association for the dengue virus envelope proteinDavid M Rogers, Michael S Kent, Susan B RempeChemsuschem|May 4, 2018
Molecular Simulation Results on Charged Carbon Nanotube Forest-Based SupercapacitorsAjay Muralidharan, Lawrence R Pratt, Gary G Hoffman, et al.Journal of Chemical Theory and Computation|July 26, 2011
A theoretical study of aqueous solvation of K comparing ab initio, polarizable, and fixed-charge modelsTroy W Whitfield, Sameer Varma, Edward Harder, et al.Chemical Science|July 14, 2021
Thermodynamics of ion binding and occupancy in potassium channelsZhifeng Jing, Joshua A Rackers, Lawrence R Pratt, et al.Journal of Chemical Theory and Computation|November 2, 2016
Scaling Atomic Partial Charges of Carbonate Solvents for Lithium Ion Solvation and DiffusionMangesh I Chaudhari, Jijeesh R Nair, Lawrence R Pratt, et al.The Journal of Physical Chemistry. B|May 17, 2018
Role of Solute Attractive Forces in the Atomic-Scale Theory of Hydrophobic EffectsAng Gao, Liang Tan, Mangesh I Chaudhari, et al.Langmuir : the ACS Journal of Surfaces and Colloids|June 4, 2014
Spatiotemporal pH dynamics in concentration polarization near ion-selective membranesMathias B Andersen, David M Rogers, Junyu Mai, et al.The Journal of Chemical Physics|May 28, 2005
Ab initio molecular dynamics study of glycine intramolecular proton transfer in waterKevin Leung, Susan B RempeBiochemistry|June 27, 2012
Combined density functional theory (DFT) and continuum calculations of pKa in carbonic anhydraseDian Jiao, Susan B RempePhysical Chemistry Chemical Physics : PCCP|June 6, 2006
Ab initio rigid water: effect on water structure, ion hydration, and thermodynamicsKevin Leung, Susan B RempePageof 19