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The Journal of Chemical Physics|July 8, 2008
Formulation of improved basis sets for the study of polymer dynamics through diffusion theory methodsRoberto Gaspari, Arnaldo RapalloJournal of Computational Chemistry|December 22, 2020
Extended diffusion theory: Recovering dynamics from biased/accelerated molecular simulationsArnaldo Rapallo, Roberto Gaspari, Gianvito Grasso, et al.Journal of Computational Chemistry|January 19, 2006
An algorithm for the uniform sampling of iso-energy surfaces and for the calculation of microcanonical averagesArnaldo RapalloThe Journal of Chemical Physics|August 31, 2004
Potential energy constrained molecular dynamics simulationsArnaldo RapalloThe Journal of Chemical Physics|August 7, 2009
VARICELLA: a variable-cell direct space method for structure determination from powder diffraction dataArnaldo RapalloThe Journal of Chemical Physics|February 29, 2024
Fractional Extended Diffusion Theory to capture anomalous relaxation from biased/accelerated molecular simulationsArnaldo RapalloJournal of Chemical Theory and Computation|July 11, 2025
Upper-Order TICA and Fractional Non-Markovian Process to Model Anomalous Dynamic RegimesArnaldo RapalloThe Journal of Chemical Physics|February 10, 2011
Clusters in strong polyelectrolyte solutions in the condensation theory approachAngelo Perico, Arnaldo RapalloJournal of the American Chemical Society|May 14, 2016
Influence of the Ion Coordination Number on Cation Exchange Reactions with Copper Telluride NanocrystalsRenyong Tu, Yi Xie, Giovanni Bertoni, et al.The Journal of Chemical Physics|March 18, 2014
Peptide dynamics by molecular dynamics simulation and diffusion theory method with improved basis setsPo Jen Hsu, S K Lai, Arnaldo RapalloPageof 4