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Physical Review Letters|March 5, 2009
Langevin equation with colored noise for constant-temperature molecular dynamics simulationsMichele Ceriotti, Giovanni Bussi, Michele Parrinello
Physical Review Letters|August 8, 2009
Nuclear quantum effects in solids using a colored-noise thermostatMichele Ceriotti, Giovanni Bussi, Michele Parrinello
Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics|October 13, 2007
Conjugate gradient heat bath for ill-conditioned actionsMichele Ceriotti, Giovanni Bussi, Michele Parrinello
Iucrj|April 14, 2015
Metadynamics studies of crystal nucleationFederico Giberti, Matteo Salvalaglio, Michele Parrinello
Journal of Molecular Biology|June 8, 2002
Role of conformational fluctuations in the enzymatic reaction of HIV-1 proteaseStefano Piana, Paolo Carloni, Michele Parrinello
Journal of the American Chemical Society|August 23, 2011
Effect of urea on the β-hairpin conformational ensemble and protein denaturation mechanismAnna Berteotti, Alessandro Barducci, Michele Parrinello
Physical Review Letters|September 28, 2004
Correlations among hydrogen bonds in liquid waterPaolo Raiteri, Alessandro Laio, Michele Parrinello
Journal of Chemical Theory and Computation|November 5, 2016
Hierarchical Protein Free Energy Landscapes from Variationally Enhanced SamplingPatrick Shaffer, Omar Valsson, Michele Parrinello
Proceedings of the National Academy of Sciences of the United States of America|October 9, 2019
Path integral molecular dynamics for bosonsBarak Hirshberg, Valerio Rizzi, Michele Parrinello
Acta Crystallographica. Section C, Structural Chemistry|February 11, 2014
1,3,5-Tris(4-bromophenyl)benzene prenucleation clusters from metadynamicsMatteo Salvalaglio, Federico Giberti, Michele Parrinello
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