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Scientific Reports|February 13, 2015
Energetics and structural characterization of the large-scale functional motion of adenylate kinaseElena Formoso, Vittorio Limongelli, Michele ParrinelloThe Journal of Chemical Physics|May 10, 2020
Path integral molecular dynamics for fermions: Alleviating the sign problem with the Bogoliubov inequalityBarak Hirshberg, Michele Invernizzi, Michele ParrinelloPhysical Review Letters|July 15, 2003
Efficient exploration of reactive potential energy surfaces using Car-Parrinello molecular dynamicsMarcella Iannuzzi, Alessandro Laio, Michele ParrinelloThe Journal of Chemical Physics|May 22, 2023
Deep learning collective variables from transition path ensembleDhiman Ray, Enrico Trizio, Michele ParrinelloThe Journal of Chemical Physics|July 23, 2004
Dispersion corrections to density functionals for water aromatic interactionsUrs Zimmerli, Michele Parrinello, Petros KoumoutsakosJournal of Chemical Theory and Computation|November 19, 2015
Assessing the Reliability of the Dynamics Reconstructed from MetadynamicsMatteo Salvalaglio, Pratyush Tiwary, Michele ParrinelloJournal of Chemical Theory and Computation|November 22, 2015
Metadynamics with Adaptive GaussiansDavide Branduardi, Giovanni Bussi, Michele ParrinelloProceedings of the National Academy of Sciences of the United States of America|January 21, 2016
Enhanced, targeted sampling of high-dimensional free-energy landscapes using variationally enhanced sampling, with an application to chignolinPatrick Shaffer, Omar Valsson, Michele ParrinelloJournal of Chemical Theory and Computation|April 9, 2016
Bespoke Bias for Obtaining Free Energy Differences within Variationally Enhanced SamplingJames McCarty, Omar Valsson, Michele ParrinelloJournal of Chemical Theory and Computation|September 18, 2018
Metadynamics with Discriminants: A Tool for Understanding ChemistryGiovanniMaria Piccini, Dan Mendels, Michele ParrinelloPageof 28