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Physical Review Letters|November 26, 2019
Simulating Electrochemical Systems by Combining the Finite Field Method with a Constant Potential ElectrodeThomas Dufils, Guillaume Jeanmairet, Benjamin Rotenberg, et al.Journal of Computational Chemistry|February 6, 2013
A multiscale coarse-grained polarizable solvent model for handling long tail bulk electrostaticsMichel Masella, Daniel Borgis, Philippe CuniassePhysical Chemistry Chemical Physics : PCCP|June 21, 2013
Computing Wigner distributions and time correlation functions using the quantum thermal bath method: application to proton transfer spectroscopyMarie Basire, Daniel Borgis, Rodolphe VuilleumierJournal of Computational Chemistry|June 8, 2011
Combining a polarizable force-field and a coarse-grained polarizable solvent model. II. Accounting for hydrophobic effectsMichel Masella, Daniel Borgis, Philippe CuniasseJournal of Chemical Theory and Computation|December 3, 2015
Coarse-Graining the Accessible Surface and the Electrostatics of Proteins for Protein-Protein InteractionsFrancesco Pizzitutti, Massimo Marchi, Daniel BorgisJournal of Computational Chemistry|March 21, 2008
Combining a polarizable force-field and a coarse-grained polarizable solvent model: application to long dynamics simulations of bovine pancreatic trypsin inhibitorMichel Masella, Daniel Borgis, Philippe CuniasseThe Journal of Chemical Physics|July 27, 2012
Scalar fundamental measure theory for hard spheres in three dimensions: application to hydrophobic solvationMaximilien Levesque, Rodolphe Vuilleumier, Daniel BorgisThe Journal of Chemical Physics|September 1, 2006
Quantized time correlation function approach to nonadiabatic decay rates in condensed phase: application to solvated electrons in water and methanolDaniel Borgis, Peter J Rossky, László TuriThe Journal of Chemical Physics|November 13, 2007
Nuclear quantum effects on the nonadiabatic decay mechanism of an excited hydrated electronDaniel Borgis, Peter J Rossky, László TuriThe Journal of Chemical Physics|October 11, 2023
Grand-canonical molecular dynamics simulations powered by a hybrid 4D nonequilibrium MD/MC method: Implementation in LAMMPS and applications to electrolyte solutionsJeongmin Kim, Luc Belloni, Benjamin RotenbergPageof 8