Maurizio Recanatini

16 papers Journal 15Unranked 1
YearRankTypeTitle / Venue / Authors
2021 J jnl
Targeting the JAK/STAT Pathway: A Combined Ligand- and Target-Based Approach.
J. Chem. Inf. Model.
María Gálvez-Llompart, Riccardo Ocello, Laura Rullo, Serena Stamatakos, Irene Alessandrini, Riccardo Zanni, Iñaki Tuñón, Andrea Cavalli, Sanzio Candeletti, Matteo Masetti, Patrizia Romualdi, Maurizio Recanatini
2020 J jnl
Conduction and Gating Properties of the TRAAK Channel from Molecular Dynamics Simulations with Different Force Fields.
J. Chem. Inf. Model.
Riccardo Ocello, Simone Furini, Francesca Lugli, Maurizio Recanatini, Carmen Domene, Matteo Masetti
2020 J jnl
Exploring Conformational Dynamics of the Extracellular Venus flytrap Domain of the GABAB Receptor: A Path-Metadynamics Study.
J. Chem. Inf. Model.
Linn S. M. Evenseth, Riccardo Ocello, Mari Gabrielsen, Matteo Masetti, Maurizio Recanatini, Ingebrigt Sylte, Andrea Cavalli
2019 J jnl
Predicting Residence Time and Drug Unbinding Pathway through Scaled Molecular Dynamics.
J. Chem. Inf. Model.
Doris A. Schuetz, Mattia Bernetti, Martina Bertazzo, Djordje Musil, Hans-Michael Eggenweiler, Maurizio Recanatini, Matteo Masetti, Gerhard F. Ecker, Andrea Cavalli
2018 J jnl
Binding Residence Time through Scaled Molecular Dynamics: A Prospective Application to hDAAO Inhibitors.
J. Chem. Inf. Model.
Mattia Bernetti, Elena Rosini, Luca Mollica, Matteo Masetti, Loredano Pollegioni, Maurizio Recanatini, Andrea Cavalli
2018 J jnl
Fully Flexible Docking via Reaction-Coordinate-Independent Molecular Dynamics Simulations.
J. Chem. Inf. Model.
Martina Bertazzo, Mattia Bernetti, Maurizio Recanatini, Matteo Masetti, Andrea Cavalli
2017 J jnl
Development of a multisite model for Ni(II) ion in solution from thermodynamic and kinetic data.
J. Comput. Chem.
Matteo Masetti, Francesco Musiani, Mattia Bernetti, Federico Falchi, Andrea Cavalli, Stefano Ciurli, Maurizio Recanatini
2013 J jnl
An Automated Docking Protocol for hERG Channel Blockers.
J. Chem. Inf. Model.
Giovanni Paolo Di Martino, Matteo Masetti, Luisa Ceccarini, Andrea Cavalli, Maurizio Recanatini
2013 J jnl
Collecting and Assessing Human Lactate Dehydrogenase-A Conformations for Structure-Based Virtual Screening.
J. Chem. Inf. Model.
Rosa Buonfiglio, Mariarosaria Ferraro, Federico Falchi, Andrea Cavalli, Matteo Masetti, Maurizio Recanatini
2011 J jnl
Computational investigation of the binding mode of bis(hydroxylphenyl)arenes in 17β-HSD1: molecular dynamics simulations, MM-PBSA free energy calculations, and molecular electrostatic potential maps.
J. Comput. Aided Mol. Des.
Matthias Negri, Maurizio Recanatini, Rolf W. Hartmann
2008 J jnl
Alpha7 nicotinic acetylcholine receptor agonists: Prediction of their binding affinity through a molecular mechanics Poisson-Boltzmann surface area approach.
J. Comput. Chem.
Giovanni Grazioso, Andrea Cavalli, Marco De Amici, Maurizio Recanatini, Carlo De Micheli
2008 J jnl
Mechanical Features of
J. Chem. Inf. Model.
Francesco Colizzi, Maurizio Recanatini, Andrea Cavalli
2008 J jnl
Modeling the hERG potassium channel in a phospholipid bilayer: Molecular dynamics and drug docking studies.
J. Comput. Chem.
Matteo Masetti, Andrea Cavalli, Maurizio Recanatini
2006 J jnl
A Comparative Study on the Application of Hierarchical-Agglomerative Clustering Approaches to Organize Outputs of Reiterated Docking Runs.
J. Chem. Inf. Model.
Giovanni Bottegoni, Andrea Cavalli, Maurizio Recanatini
2006 — conf
AClAP, Autonomous hierarchical agglomerative Cluster Analysis based protocol to partition conformational datasets.
ISMB (Supplement of Bioinformatics)
Giovanni Bottegoni, Walter Rocchia, Maurizio Recanatini, Andrea Cavalli
1996 J jnl
Comparative molecular field analysis of non-steroidal aromatase inhibitors related to fadrozole.
J. Comput. Aided Mol. Des.
Maurizio Recanatini