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Proteins|May 8, 2001
Molecular dynamics studies on HIV-1 protease drug resistance and folding pathwaysF Cecconi, C Micheletti, P Carloni, et al.
Journal of Biological Inorganic Chemistry : JBIC : a Publication of the Society of Biological Inorganic Chemistry|May 20, 2000
A comparative study of galactose oxidase and active site analogs based on QM/MM Car-Parrinello simulationsU Rothlisberger, P Carloni, K Doclo, et al.
Journal of the American Chemical Society|September 6, 2001
Ab initio molecular dynamics-based assignment of the protonation state of pepstatin A/HIV-1 protease cleavage siteS Piana, D Sebastiani, P Carloni, et al.
The Journal of Physical Chemistry. A|November 16, 2007
Large-scale motions and electrostatic properties of furin and HIV-1 proteaseV Carnevale, S Raugei, C Micheletti, et al.
The Journal of Chemical Physics|December 16, 2014
Hydration of chloride anions in the NanC Porin from Escherichia coli: a comparative study by QM/MM and MD simulationsV Calandrini, J Dreyer, E Ippoliti, et al.
Biophysical Journal|August 1, 2006
Using metadynamics to understand the mechanism of calmodulin/target recognition at atomic detailG Fiorin, A Pastore, P Carloni, et al.
Free Radical Research|September 18, 1999
Reactivity of an indolinonic aminoxyl with superoxide anion and hydroxyl radicalsE Damiani, P Carloni, P Stipa, et al.
Biophysical Journal|June 14, 2005
A homology model of the pore region of HCN channelsA Giorgetti, P Carloni, P Mistrik, et al.
Wiener Klinische Wochenschrift|July 30, 2011
Prasugrel vs. ticagrelor in acute coronary syndromes: which one to choose?Hannes F Alber, Kurt Huber, Otmar Pachinger, et al.
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