Results 201 to 210 of about 15,544 (215)

Dynamics of melting and stability of ice 1h: Molecular-dynamics simulations of the SPC/E model of water

Journal of Chemical Physics, 2002
E J Smith, A D J Haymet, Haymet A D J
exaly  

On the structure and rejection of ions by a polyamide membrane in pressure-driven molecular dynamics simulations

Desalination, 2015
Anthony Szymczyk, Aziz Ghoufi
exaly  

Amplitudes and Frequencies of Protein Dynamics:  Analysis of Discrepancies between Neutron Scattering and Molecular Dynamics Simulations

Journal of the American Chemical Society, 2000
Mounir Tarek, Glenn J MARTYNA, Douglas J Tobias   +2 more
exaly  

Molecular Dynamics Simulations of Peptides

2008
Jeffrey, Copps, Richard F, Murphy, Sandor, Lovas   +2 more
openaire   +2 more sources

Error and efficiency of replica exchange molecular dynamics simulations

Journal of Chemical Physics, 2009
Edina Rosta, Gerhard Hummer, Hummer Gerhard   +2 more
exaly  

NMR Experiments and Molecular Dynamics Simulations of the Segmental Dynamics of Polystyrene

Macromolecules, 2004
Yiyong He, T R Lutz, M D Ediger
exaly  

Molecular Dynamics:  Survey of Methods for Simulating the Activity of Proteins

Chemical Reviews, 2006
J Andrew McCammon
exaly  

Significance of Molecular Dynamics Simulations for Life Sciences

Israel Journal of Chemistry, 2014
Richard Lavery
exaly  

Nonadiabatic Molecular Dynamics Simulations: Synergies between Theory and Experiments

Accounts of Chemical Research, 2015
Ivano Tavernelli
exaly  

RNA Structural Dynamics As Captured by Molecular Simulations: A Comprehensive Overview

Chemical Reviews, 2018
Jiří Sponer, Giovanni Bussi, Miroslav Krepl   +2 more
exaly