Alessio Lodola

Publication Activity (10 Years)

Years Active: 2008-2023
Publications (10 Years): 8

Top Topics

Crowd Simulation

Factors That Influence

Top Venues

J. Chem. Inf. Model.

Publications

Lorenzo Guidetti, Alfonso Zappia, Laura Scalvini, Francesca Romana Ferrari, Carmine Giorgio, Riccardo Castelli, Francesca Galvani, Federica Vacondio, Silvia Rivara, Marco Mor, Chiara Urbinati, Marco Rusnati, Massimiliano Tognolini, Alessio Lodola
Molecular Determinants of EphA2 and EphB2 Antagonism Enable the Design of Ligands with Improved Selectivity. J. Chem. Inf. Model. 63 (21) (2023)
Kemel Arafet, Laura Scalvini, Francesca Galvani, Sergio Martí, Vicent Moliner, Marco Mor, Alessio Lodola
Mechanistic Modeling of Lys745 Sulfonylation in EGFR C797S Reveals Chemical Determinants for Inhibitor Activity and Discriminates Reversible from Irreversible Agents. J. Chem. Inf. Model. 63 (4) (2023)
Francesca Galvani, Daniele Pala, Alberto Cuzzolin, Laura Scalvini, Alessio Lodola, Marco Mor, Andrea Rizzi
Unbinding Kinetics of Muscarinic M3 Receptor Antagonists Explained by Metadynamics Simulations. J. Chem. Inf. Model. 63 (9) (2023)
Francesca Galvani, Laura Scalvini, Silvia Rivara, Alessio Lodola, Marco Mor
Mechanistic Modeling of Monoglyceride Lipase Covalent Modification Elucidates the Role of Leaving Group Expulsion and Discriminates Inhibitors with High and Low Potency. J. Chem. Inf. Model. 62 (11) (2022)
Gian Marco Elisi, Laura Scalvini, Alessio Lodola, Marco Mor, Silvia Rivara
Free-Energy Simulations Support a Lipophilic Binding Route for Melatonin Receptors. J. Chem. Inf. Model. 62 (1) (2022)
Donatella Callegari, Alessio Lodola, Daniele Pala, Silvia Rivara, Marco Mor, Andrea Rizzi, Anna Maria Capelli
Metadynamics Simulations Distinguish Short- and Long-Residence-Time Inhibitors of Cyclin-Dependent Kinase 8. J. Chem. Inf. Model. 57 (2) (2017)
Donatella Callegari, Alessio Lodola, Daniele Pala, Silvia Rivara, Marco Mor, Andrea Rizzi, Anna Maria Capelli
Correction to Metadynamics Simulations Distinguish Short- and Long-Residence-Time Inhibitors of Cyclin-Dependent Kinase 8. J. Chem. Inf. Model. 57 (2) (2017)
Luigi Capoferri, Alessio Lodola, Silvia Rivara, Marco Mor
-(4-Anilinoquinazolin-6-yl) Acrylamide. J. Chem. Inf. Model. 55 (3) (2015)
Daniele Pala, Riccardo Castelli, Matteo Incerti, Simonetta Russo, Massimiliano Tognolini, Carmine Giorgio, Iftiin Hassan-Mohamed, Ilaria Zanotti, Federica Vacondio, Silvia Rivara, Marco Mor, Alessio Lodola
Combining Ligand- and Structure-Based Approaches for the Discovery of New Inhibitors of the EPHA2-ephrin-A1 Interaction. J. Chem. Inf. Model. 54 (10) (2014)
Daniele Pala, Thijs Beuming, Woody Sherman, Alessio Lodola, Silvia Rivara, Marco Mor
Melatonin Receptor: Influence of Template Choice and Structural Refinement. J. Chem. Inf. Model. 53 (4) (2013)
Christo Z. Christov, Tatyana G. Karabencheva, Alessio Lodola
Relationship between chiroptical properties, structural changes and interactions in enzymes: A computational study on beta-lactamases from class A. Comput. Biol. Chem. 32 (3) (2008)