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Journal of the American Chemical Society|April 16, 2008
Metal-carbon nanotube contacts: the link between Schottky barrier and chemical bondingVincenzo Vitale, Alessandro Curioni, Wanda AndreoniJournal of Computer-Aided Molecular Design|August 3, 2005
Enhancing the accuracy of virtual screening: molecular dynamics with quantum-refined force fieldsAlessandro Curioni, Tiziana Mordasini, Wanda AndreoniThe Journal of Biological Chemistry|December 24, 2002
Why do divalent metal ions either promote or inhibit enzymatic reactions? The case of BamHI restriction endonuclease from combined quantum-classical simulationsTiziana Mordasini, Alessandro Curioni, Wanda AndreoniPhysical Chemistry Chemical Physics : PCCP|April 6, 2011
Which similarity measure is better for analyzing protein structures in a molecular dynamics trajectory?Pilar Cossio, Alessandro Laio, Fabio PietrucciThe Journal of Physical Chemistry Letters|September 4, 2020
Out-of-Equilibrium Polymorph Selection in Nanoparticle FreezingJonathan Amodeo, Fabio Pietrucci, Julien LamThe Journal of Physical Chemistry Letters|August 19, 2015
Mapping the Native Conformational Ensemble of Proteins from a Combination of Simulations and Experiments: New Insight into the src-SH3 DomainFabio Pietrucci, Luca Mollica, Martin BlackledgeScientific Reports|December 23, 2015
HIV-1 Protease Dimerization Dynamics Reveals a Transient Druggable Binding Pocket at the InterfaceFabio Pietrucci, Attilio Vittorio Vargiu, Agata KranjcThe Journal of Physical Chemistry Letters|March 15, 2021
Step by Step Strecker Amino Acid Synthesis from Ab Initio Prebiotic ChemistryThéo Magrino, Fabio Pietrucci, A Marco SaittaPhysical Review Letters|March 16, 2007
Anomalous behavior of the dielectric constant of hafnium silicates: a first principles studyCarlo A Pignedoli, Alessandro Curioni, Wanda AndreoniPhysical Review Letters|May 21, 2005
Ab initio design of high-k dielectrics: La(x)Y1-xAlO3Stephen A Shevlin, Alessandro Curioni, Wanda AndreoniPageof 8