Showing results (51-60 of 2,205) with videos related to
Sort By:
Pageof 221
Chirality|May 28, 2011
A quantitative measure of chirality inside nucleic acid databankAdriana Pietropaolo, Michele ParrinelloThe Journal of Physical Chemistry. A|January 15, 2015
Combustion chemistry via metadynamics: benzyl decomposition revisitedDaniela Polino, Michele ParrinelloPhysical Review Letters|January 13, 2019
Silicon Liquid Structure and Crystal Nucleation from Ab Initio Deep MetadynamicsLuigi Bonati, Michele ParrinelloJournal of Chemical Theory and Computation|March 2, 2019
Making the Best of a Bad Situation: A Multiscale Approach to Free Energy CalculationMichele Invernizzi, Michele ParrinelloPhysical Review Letters|January 31, 2014
From metadynamics to dynamicsPratyush Tiwary, Michele ParrinelloProceedings of the National Academy of Sciences of the United States of America|February 27, 2024
Data-driven classification of ligand unbinding pathwaysDhiman Ray, Michele ParrinelloFaraday Discussions|February 18, 2005
Simulation of interfaces between room temperature ionic liquids and other liquidsR M Lynden-Bell, J Kohanoff, M G Del PopoloThe Journal of Physical Chemistry. B|March 29, 2007
Neutral and charged 1-butyl-3-methylimidazolium triflate clusters: equilibrium concentration in the vapor phase and thermal properties of nanometric dropletsP Ballone, C Pinilla, J Kohanoff, et al.The Journal of Physical Chemistry. B|April 28, 2006
Solvation structure and transport of acidic protons in ionic liquids: a first-principles simulation studyMario G Del Pópolo, Jorge Kohanoff, Ruth M Lynden-BellPhysical Review Letters|September 28, 2010
Enhanced sampling in the well-tempered ensembleM Bonomi, M ParrinelloPageof 221