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Journal of Computational Chemistry|April 7, 2004
A semi-implicit solvent model for the simulation of peptides and proteinsNathalie Basdevant, Daniel Borgis, Tap Ha-DuongThe Journal of Physical Chemistry. B|July 10, 2007
A coarse-grained protein-protein potential derived from an all-atom force fieldNathalie Basdevant, Daniel Borgis, Tap Ha-DuongJournal of Chemical Theory and Computation|November 22, 2015
Modeling Protein-Protein Recognition in Solution Using the Coarse-Grained Force Field SCORPIONNathalie Basdevant, Daniel Borgis, Tap Ha-DuongJournal of Chemical Theory and Computation|December 3, 2015
Particle-Based Implicit Solvent Model for Biosimulations: Application to Proteins and Nucleic Acids HydrationNathalie Basdevant, Tap Ha-Duong, Daniel BorgisThe Journal of Physical Chemistry Letters|May 6, 2017
Electronic Excited State Lifetimes of Anionic Water Clusters: Dependence on Charge Solvation MotifDaniel Borgis, Peter J Rossky, László TuriThe Journal of Chemical Physics|May 24, 2011
Molecular density functional theory of solvation: from polar solvents to waterShuangliang Zhao, Rosa Ramirez, Rodolphe Vuilleumier, et al.Journal of Chemical Theory and Computation|March 7, 2017
Semistochastic Heat-Bath Configuration Interaction Method: Selected Configuration Interaction with Semistochastic Perturbation TheorySandeep Sharma, Adam A Holmes, Guillaume Jeanmairet, et al.The Journal of Chemical Physics|July 26, 2013
Accurate evaluation of the angular-dependent direct correlation function of waterShuangliang Zhao, Honglai Liu, Rosa Ramirez, et al.Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics|October 9, 2002
Density functional theory of solvation in a polar solvent: extracting the functional from homogeneous solvent simulationsRosa Ramirez, Ralph Gebauer, Michel Mareschal, et al.The Journal of Chemical Physics|September 8, 2022
Electron transfer of functionalized quinones in acetonitrileTzu-Yao Hsu, Roxanne Berthin, Alessandra Serva, et al.Pageof 8