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Journal of the American Chemical Society|October 1, 2009
Exploring ion permeation energetics in gramicidin A using polarizable charge equilibration force fieldsSandeep Patel, Joseph E Davis, Brad A BauerThe Journal of Physical Chemistry. B|July 3, 2009
Interfacial structure, thermodynamics, and electrostatics of aqueous methanol solutions via molecular dynamics simulations using charge equilibration modelsSandeep Patel, Yang Zhong, Brad A Bauer, et al.Journal of Computational Chemistry|September 24, 2010
Molecular dynamics simulations of aqueous ions at the liquid-vapor interface accelerated using graphics processorsBrad A Bauer, Joseph E Davis, Michela Taufer, et al.Journal of Computational Chemistry|October 15, 2011
Molecular dynamics simulation of hydrated DPPC monolayers using charge equilibration force fieldsTimothy R Lucas, Brad A Bauer, Joseph E Davis, et al.Journal of Molecular Graphics & Modelling|March 19, 2011
Phase-transfer energetics of small-molecule alcohols across the water-hexane interface: molecular dynamics simulations using charge equilibration modelsBrad A Bauer, Yang Zhong, David J Meninger, et al.The Journal of Chemical Physics|January 26, 2010
Molecular dynamics simulations of nonpolarizable inorganic salt solution interfaces: NaCl, NaBr, and NaI in transferable intermolecular potential 4-point with charge dependent polarizability (TIP4P-QDP) waterBrad A Bauer, Sandeep PatelThe Journal of Chemical Physics|September 4, 2009
Properties of water along the liquid-vapor coexistence curve via molecular dynamics simulations using the polarizable TIP4P-QDP-LJ water modelBrad A Bauer, Sandeep PatelThe Journal of Physical Chemistry. B|June 1, 2010
Role of electrostatics in modulating hydrophobic interactions and barriers to hydrophobic assemblyBrad A Bauer, Sandeep PatelPhysical Chemistry Chemical Physics : PCCP|January 11, 2012
Role of spatial ionic distribution on the energetics of hydrophobic assembly and properties of the water/hydrophobe interfaceBrad A Bauer, Shuching Ou, Sandeep PatelJournal of Computational Chemistry|September 8, 2011
Solvation properties of N-acetyl-β-glucosamine: molecular dynamics study incorporating electrostatic polarizationYang Zhong, Brad A Bauer, Sandeep PatelPageof 23