Francesco Luigi Gervasio

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Indice H	51	35
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michele parrinelloDepartment of ChemistryEmail verificata su phys.chem.ethz.ch
Giorgio SaladinoUniversity College London (UCL)Email verificata su ucl.ac.uk
Alessandro LaioSISSAEmail verificata su sissa.it
Ludovico SuttoResearch Associate at University College LondonEmail verificata su ucl.ac.uk
Vincenzo SchettinoEmail verificata su lens.unifi.it
Andrea CavalliProfessor & Vice Scientific Director - Italian Institute of Technology & University of BolognaEmail verificata su unibo.it
Piero ProcacciComputational chemist, University of FlorenceEmail verificata su unifi.it
Davide BranduardiComputational Chemistry & Informatics Group at AstexEmail verificata su astx.com
Riccardo ChelliDepartment of Chemistry, University of Florence, ItalyEmail verificata su unifi.it
Paolo CarloniForschungszentrum JülichEmail verificata su fz-juelich.de
Gianni CardiniProfessor of Chemical Physics, Department of Chemistry, University of FirenzeEmail verificata su unifi.it
Maurizio RecanatiniProfessor of Medicinal Chemistry, University of BolognaEmail verificata su unibo.it
Giovanni BussiScuola Internazionale Superiore di Studi Avanzati, Trieste, ItalyEmail verificata su sissa.it
Massimiliano BonomiInstitut Pasteur - CNRSEmail verificata su pasteur.fr
Prof Giuseppe BattagliaDept Chemistry at UCL & ICREA Professor at Institute for Bioengineering of Catalonia (IBEC) -BISTEmail verificata su ucl.ac.uk
Antonija KuzmanicSchrödingerEmail verificata su schrodinger.com
Silvia LoveraUCB BioPharmaEmail verificata su ucb.com
Federico ComitaniThe Hospital for Sick Children, TorontoEmail verificata su sickkids.ca
Elena PapaleoComputational Biology Laboratory, Danish Cancer Society Research CenterEmail verificata su cancer.dk
Kresten Lindorff-LarsenLinderstrøm-Lang Centre for Protein Science, Department of Biology, University of CopenhagenEmail verificata su bio.ku.dk

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Francesco Luigi Gervasio

Professor of Pharmaceutical Sciences at University of Geneva & Professor of Chemistry UCL

Email verificata su ucl.ac.uk - Home page

Computational Chemistry Molecular Dynamics Signaling Proteins Biophysics Computational Biophysics


Titolo Ordina per citazioni Ordina per anno Ordina per titolo	Citata da Citata da	Anno
Metadynamics: a method to simulate rare events and reconstruct the free energy in biophysics, chemistry and material science A Laio, FL Gervasio Reports on Progress in Physics 71 (12), 126601, 2008	1488	2008
Assessing the accuracy of metadynamics A Laio, A Rodriguez-Fortea, FL Gervasio, M Ceccarelli, M Parrinello The journal of physical chemistry B 109 (14), 6714-6721, 2005	551	2005
Efficient reconstruction of complex free energy landscapes by multiple walkers metadynamics P Raiteri, A Laio, FL Gervasio, C Micheletti, M Parrinello The journal of physical chemistry B 110 (8), 3533-3539, 2006	502	2006
Free-energy landscape for β hairpin folding from combined parallel tempering and metadynamics G Bussi, FL Gervasio, A Laio, M Parrinello Journal of the American Chemical Society 128 (41), 13435-13441, 2006	499	2006
From to in free energy space D Branduardi, FL Gervasio, M Parrinello The Journal of chemical physics 126 (5), 054103, 2007	463	2007
Flexible docking in solution using metadynamics FL Gervasio, A Laio, M Parrinello Journal of the American Chemical Society 127 (8), 2600-2607, 2005	301	2005
Promoting transparency and reproducibility in enhanced molecular simulations M Bonomi, G Bussi, C Camilloni, GA Tribello, P Banáš, A Barducci, ... Nature methods 16 (8), 670-673, 2019	287	2019
Stacking and T-shape competition in aromatic− aromatic amino acid interactions R Chelli, FL Gervasio, P Procacci, V Schettino Journal of the American Chemical Society 124 (21), 6133-6143, 2002	269	2002
The role of protein loops and linkers in conformational dynamics and allostery E Papaleo, G Saladino, M Lambrughi, K Lindorff-Larsen, FL Gervasio, ... Chemical reviews 116 (11), 6391-6423, 2016	261	2016
Molecular basis of cyclooxygenase enzymes (COXs) selective inhibition V Limongelli, M Bonomi, L Marinelli, FL Gervasio, A Cavalli, E Novellino, ... Proceedings of the National Academy of Sciences 107 (12), 5411-5416, 2010	209	2010
Electronic structure of wet DNA FL Gervasio, P Carloni, M Parrinello Physical review letters 89 (10), 108102, 2002	199	2002
Effects of oncogenic mutations on the conformational free-energy landscape of EGFR kinase L Sutto, FL Gervasio Proceedings of the National Academy of Sciences 110 (26), 10616-10621, 2013	154	2013
New advances in metadynamics L Sutto, S Marsili, FL Gervasio Wiley Interdisciplinary Reviews: Computational Molecular Science 2 (5), 771-779, 2012	138	2012
Protein conformational transitions: the closure mechanism of a kinase explored by atomistic simulations A Berteotti, A Cavalli, D Branduardi, FL Gervasio, M Recanatini, ... Journal of the American Chemical Society 131 (1), 244-250, 2009	126	2009
Inhibition of tumor angiogenesis and growth by a small-molecule multi-FGF receptor blocker with allosteric properties F Bono, F De Smet, C Herbert, K De Bock, M Georgiadou, P Fons, M Tjwa, ... Cancer cell 23 (4), 477-488, 2013	125	2013
The role of the peripheral anionic site and cation− π interactions in the ligand penetration of the human AChE gorge D Branduardi, FL Gervasio, A Cavalli, M Recanatini, M Parrinello Journal of the American Chemical Society 127 (25), 9147-9155, 2005	125	2005
From residue coevolution to protein conformational ensembles and functional dynamics L Sutto, S Marsili, A Valencia, FL Gervasio Proceedings of the National Academy of Sciences 112 (44), 13567-13572, 2015	120	2015
Metadynamics simulation of prion protein: β-structure stability and the early stages of misfolding A Barducci, R Chelli, P Procacci, V Schettino, FL Gervasio, M Parrinello Journal of the American Chemical Society 128 (8), 2705-2710, 2006	120	2006
Investigating drug–target association and dissociation mechanisms using metadynamics-based algorithms A Cavalli, A Spitaleri, G Saladino, FL Gervasio Accounts of chemical research 48 (2), 277-285, 2015	119	2015
Phosphatidylinositol 4, 5-bisphosphate triggers activation of focal adhesion kinase by inducing clustering and conformational changes GM Goñi, C Epifano, J Boskovic, M Camacho-Artacho, J Zhou, ... Proceedings of the National Academy of Sciences 111 (31), E3177-E3186, 2014	115	2014

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