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The Journal of Physical Chemistry. B|February 24, 2006
Structure and function of vanadium haloperoxidasesSimone Raugei, Paolo CarloniCurrent Opinion in Chemical Biology|January 28, 2003
Molecular modeling of ion channels: structural predictionsAlejandro Giorgetti, Paolo CarloniJournal of the American Chemical Society|April 4, 2002
Enzymatic GTP hydrolysis: insights from an ab initio molecular dynamics studyAndrea Cavalli, Paolo CarloniCurrent Opinion in Structural Biology|May 25, 2024
Impact of quantum and neuromorphic computing on biomolecular simulations: Current status and perspectivesSandra Diaz-Pier, Paolo CarloniProceedings of the National Academy of Sciences of the United States of America|June 8, 2012
Water at hydrophobic interfaces delays proton surface-to-bulk transfer and provides a pathway for lateral proton diffusionChao Zhang, Denis G Knyazev, Yana A Vereshaga, et al.The Journal of Physical Chemistry Letters|June 13, 2019
Exhaustive Search of Ligand Binding Pathways via Volume-Based MetadynamicsRiccardo Capelli, Paolo Carloni, Michele ParrinelloAccounts of Chemical Research|June 19, 2002
The role and perspective of ab initio molecular dynamics in the study of biological systemsPaolo Carloni, Ursula Rothlisberger, Michele ParrinelloProteins|May 18, 2004
Dynamics and energetics of water permeation through the aquaporin channelPietro Vidossich, Michele Cascella, Paolo CarloniFEBS Letters|May 3, 2005
Molecular basis of the allosteric mechanism of cAMP in the regulatory PKA subunitSergio Pantano, Manuela Zaccolo, Paolo CarloniPageof 845