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Journal of the American Chemical Society|February 13, 2014
A conformational ensemble derived using NMR methyl chemical shifts reveals a mechanical clamping transition that gates the binding of the HU protein to DNAArvind Kannan, Carlo Camilloni, Aleksandr B Sahakyan, et al.Nature Communications|January 4, 2024
Improving deep neural network generalization and robustness to background bias via layer-wise relevance propagation optimizationPedro R A S Bassi, Sergio S J Dertkigil, Andrea CavalliJournal of the American Chemical Society|November 23, 2006
Geometry, energetics, and dynamics of hydrogen bonds in proteins: structural information derived from NMR scalar couplingsJoerg Gsponer, Harri Hopearuoho, Andrea Cavalli, et al.The Journal of Biological Chemistry|November 13, 2003
Calpain-1 regulates Bax and subsequent Smac-dependent caspase-3 activation in neutrophil apoptosisFrank Altznauer, Sébastien Conus, Andrea Cavalli, et al.Brain and Behavior|March 28, 2013
Galantamine potentiates the neuroprotective effect of memantine against NMDA-induced excitotoxicityJoão P Lopes, Glauco Tarozzo, Angelo Reggiani, et al.Bioorganic & Medicinal Chemistry Letters|March 21, 2008
Synthesis of a small library of 2-phenoxy-1,4-naphthoquinone and 2-phenoxy-1,4-anthraquinone derivatives bearing anti-trypanosomal and anti-leishmanial activityMaria Laura Bolognesi, Federica Lizzi, Remo Perozzo, et al.Journal of Chemical Information and Modeling|July 18, 2023
Molecular Dynamics and Machine Learning Give Insights on the Flexibility-Activity Relationships in Tyrosine KinomeSarmistha Majumdar, Francesco Di Palma, Francesca Spyrakis, et al.Journal of Chemical Theory and Computation|August 23, 2019
An Integrated Markov State Model and Path Metadynamics Approach To Characterize Drug Binding ProcessesMattia Bernetti, Matteo Masetti, Maurizio Recanatini, et al.Journal of the American Chemical Society|February 11, 2012
Characterization of the conformational equilibrium between the two major substates of RNase A using NMR chemical shiftsCarlo Camilloni, Paul Robustelli, Alfonso De Simone, et al.Journal of Chemical Theory and Computation|October 18, 2011
Insights into Ligand-Protein Binding from Local Mechanical ResponseJagdish Suresh Patel, Davide Branduardi, Matteo Masetti, et al.Pageof 44