Showing results (11-20 of 78) with videos related to
Sort By:
Pageof 8
Proceedings of the National Academy of Sciences of the United States of America|April 18, 2007
Structures and spectral signatures of protonated water networks in bacteriorhodopsinGerald Mathias, Dominik MarxJournal of Chemical Theory and Computation|January 14, 2016
Continuous Tempering Molecular Dynamics: A Deterministic Approach to Simulated TemperingNicolas Lenner, Gerald MathiasThe Journal of Chemical Physics|July 23, 2004
Angular resolution and range of dipole-dipole correlations in waterGerald Mathias, Paul TavanThe Journal of Physical Chemistry. B|November 26, 2009
Interfacial behavior of perchlorate versus chloride ions in aqueous solutionsMarcel D Baer, I-Feng William Kuo, Hendrik Bluhm, et al.Journal of Chemical Theory and Computation|July 18, 2017
Marcus Theory of Ion-PairingSantanu Roy, Marcel D Baer, Christopher J Mundy, et al.The Journal of Physical Chemistry Letters|August 18, 2015
Aqueous Cation-Amide Binding: Free Energies and IR Spectral Signatures by Ab Initio Molecular DynamicsEva Pluhařová, Marcel D Baer, Christopher J Mundy, et al.The Journal of Physical Chemistry. B|June 3, 2025
STEPs-SOL, a Peptoid Force Field Parameterization to Include Solvent EffectsYasmene W Elhady, Bradley S Harris, Christopher J Mundy, et al.The Journal of Chemical Physics|November 4, 2017
Electrostatic solvation free energies of charged hard spheres using molecular dynamics with density functional theory interactionsTimothy T Duignan, Marcel D Baer, Gregory K Schenter, et al.The Journal of Chemical Physics|March 29, 2013
Thermodynamics of iodide adsorption at the instantaneous air-water interfaceAbraham C Stern, Marcel D Baer, Christopher J Mundy, et al.Journal of Biological Inorganic Chemistry : JBIC : a Publication of the Society of Biological Inorganic Chemistry|July 16, 2026
Geometry, spin coupling, and dielectric control of redox potentials in [4Fe-4S] ClustersPeter S Rice, Bruno Jacob, Khushbu Agarwal, et al.Pageof 8