Protein Dynamics of the HIF-2α PAS-B Domain upon Heterodimerization and Ligand Binding

por Masetti, Matteo, Falchi, Federico, Recanatini, Maurizio
Publicado 2014

Data-Driven Molecular Dynamics: A Multifaceted Challenge

por Bernetti, Mattia, Bertazzo, Martina, Masetti, Matteo
Publicado 2020

Editorial: Recent advancements in modeling and simulations of ion channels

por Furini, Simone, Maragliano, Luca, Masetti, Matteo
Publicado 2022

Ion Conduction through the hERG Potassium Channel

por Ceccarini, Luisa, Masetti, Matteo, Cavalli, Andrea, Recanatini, Maurizio
Publicado 2012

Substrate Binding Process and Mechanistic Functioning of Type 1 11β-Hydroxysteroid Dehydrogenase from Enhanced Sampling Methods

por Favia, Angelo D., Masetti, Matteo, Recanatini, Maurizio, Cavalli, Andrea
Publicado 2011

Integrated Approach Including Docking, MD Simulations, and Network Analysis Highlights the Action Mechanism of the Cardiac hERG Activator RPR260243

por Costa, Flavio, Ocello, Riccardo, Guardiani, Carlo, Giacomello, Alberto, Masetti, Matteo
Publicado 2023

Mapping Cholesterol Interaction Sites on Serotonin Transporter through Coarse-Grained Molecular Dynamics

por Ferraro, Mariarosaria, Masetti, Matteo, Recanatini, Maurizio, Cavalli, Andrea, Bottegoni, Giovanni
Publicado 2016

Dynamic Docking: A Paradigm Shift in Computational Drug Discovery

por Gioia, Dario, Bertazzo, Martina, Recanatini, Maurizio, Masetti, Matteo, Cavalli, Andrea
Publicado 2017

Insights into Ligand–Protein Binding from Local Mechanical Response

por Patel, Jagdish Suresh, Branduardi, Davide, Masetti, Matteo, Rocchia, Walter, Cavalli, Andrea
Publicado 2011

From Acid Activation Mechanisms of Proton Conduction to Design of Inhibitors of the M2 Proton Channel of Influenza A Virus

por Aledavood, Elnaz, Selmi, Beatrice, Estarellas, Carolina, Masetti, Matteo, Luque, F. Javier
Publicado 2022

Computational drug discovery under RNA times

por Bernetti, Mattia, Aguti, Riccardo, Bosio, Stefano, Recanatini, Maurizio, Masetti, Matteo, Cavalli, Andrea
Publicado 2022

Targeting the Protein Tunnels of the Urease Accessory Complex: A Theoretical Investigation

por Masetti, Matteo, Falchi, Federico, Gioia, Dario, Recanatini, Maurizio, Ciurli, Stefano, Musiani, Francesco
Publicado 2020

Conduction and Gating Properties of the TRAAK Channel from Molecular Dynamics Simulations with Different Force Fields

por Ocello, Riccardo, Furini, Simone, Lugli, Francesca, Recanatini, Maurizio, Domene, Carmen, Masetti, Matteo
Publicado 2020

Potent Antioxidant and Anti-Tyrosinase Activity of Butein and Homobutein Probed by Molecular Kinetic and Mechanistic Studies †

por Pan, Wenkai, Giovanardi, Ilaria, Sagynova, Tomiris, Cariola, Alice, Bresciani, Veronica, Masetti, Matteo, Valgimigli, Luca
Publicado 2023

Exploring Conformational Dynamics of the Extracellular Venus flytrap Domain of the GABA(B) Receptor: A Path-Metadynamics Study

por Evenseth, Linn S. M., Ocello, Riccardo, Gabrielsen, Mari, Masetti, Matteo, Recanatini, Maurizio, Sylte, Ingebrigt, Cavalli, Andrea
Publicado 2020

Targeting the JAK/STAT Pathway: A Combined Ligand- and Target-Based Approach

por Galvez-Llompart, Maria, Ocello, Riccardo, Rullo, Laura, Stamatakos, Serena, Alessandrini, Irene, Zanni, Riccardo, Tuñón, Iñaki, Cavalli, Andrea, Candeletti, Sanzio, Masetti, Matteo, Romualdi, Patrizia, Recanatini, Maurizio
Publicado 2021

A catalytically silent FAAH-1 variant drives anandamide transport in neurons

por Fu, Jin, Bottegoni, Giovanni, Sasso, Oscar, Bertorelli, Rosalia, Rocchia, Walter, Masetti, Matteo, Guijarro, Ana, Lodola, Alessio, Armirotti, Andrea, Garau, Gianpiero, Bandiera, Tiziano, Reggiani, Angelo, Mor, Marco, Cavalli, Andrea, Piomelli, Daniele
Publicado 2011