BERTAZZO, MARTINA
BERTAZZO, MARTINA
DIPARTIMENTO DI FARMACIA E BIOTECNOLOGIE
Dottorandi
Probabilistic Pocket Druggability Prediction via One-Class Learning
2022 Riccardo Aguti; Erika Gardini; Martina Bertazzo; Sergio Decherchi; Andrea Cavalli
Machine Learning and Enhanced Sampling Simulations for Computing the Potential of Mean Force and Standard Binding Free Energy
2021 Bertazzo M.; Gobbo D.; Decherchi S.; Cavalli A.
Probing the transport of Ni(II) ions through the internal tunnels of the Helicobacter pylori UreDFG multimeric protein complex
2021 Masetti, Matteo; Bertazzo, Martina; Recanatini, Maurizio; Ciurli, Stefano; Musiani, Francesco
Data-Driven Molecular Dynamics: A Multifaceted Challenge
2020 Bernetti, Mattia; Bertazzo, Martina; Masetti, Matteo
Predicting Residence Time and Drug Unbinding Pathway through Scaled Molecular Dynamics
2019 Schuetz, Doris A.; Bernetti, Mattia; Bertazzo, Martina; Musil, Djordje; Eggenweiler, Hans-Michael; Recanatini, Maurizio; Masetti, Matteo*; Ecker, Gerhard F.; Cavalli, Andrea
Fully Flexible Docking via Reaction-Coordinate-Independent Molecular Dynamics Simulations
2018 Bertazzo, Martina; Bernetti, Mattia; Recanatini, Maurizio; Masetti, Matteo; Cavalli, Andrea
Dynamic Docking: A Paradigm Shift in Computational Drug Discovery
2017 Gioia, Dario; Bertazzo, Martina; Recanatini, Maurizio; Masetti, Matteo; Cavalli, Andrea
| Titolo | Autore(i) | Anno | Periodico | Editore | Tipo | File |
|---|---|---|---|---|---|---|
| Probabilistic Pocket Druggability Prediction via One-Class Learning | Riccardo Aguti; Erika Gardini; Martina Bertazzo; Sergio Decherchi; Andrea Cavalli | 2022-01-01 | FRONTIERS IN PHARMACOLOGY | - | 1.01 Articolo in rivista | fphar-13-870479.pdf |
| Machine Learning and Enhanced Sampling Simulations for Computing the Potential of Mean Force and Standard Binding Free Energy | Bertazzo M.; Gobbo D.; Decherchi S.; Cavalli A. | 2021-01-01 | JOURNAL OF CHEMICAL THEORY AND COMPUTATION | - | 1.01 Articolo in rivista | Bertazzo_etal2021.pdf |
| Probing the transport of Ni(II) ions through the internal tunnels of the Helicobacter pylori UreDFG multimeric protein complex | Masetti, Matteo; Bertazzo, Martina; Recanatini, Maurizio; Ciurli, Stefano; Musiani, Francesco | 2021-01-01 | JOURNAL OF INORGANIC BIOCHEMISTRY | - | 1.01 Articolo in rivista | - |
| Data-Driven Molecular Dynamics: A Multifaceted Challenge | Bernetti, Mattia; Bertazzo, Martina; Masetti, Matteo | 2020-01-01 | PHARMACEUTICALS | - | 1.01 Articolo in rivista | 2020_bernetti.pdf |
| Predicting Residence Time and Drug Unbinding Pathway through Scaled Molecular Dynamics | Schuetz, Doris A.; Bernetti, Mattia; Bertazzo, Martina; Musil, Djordje; Eggenweiler, Hans-Michael...; Recanatini, Maurizio; Masetti, Matteo*; Ecker, Gerhard F.; Cavalli, Andrea | 2019-01-01 | JOURNAL OF CHEMICAL INFORMATION AND MODELING | - | 1.01 Articolo in rivista | - |
| Fully Flexible Docking via Reaction-Coordinate-Independent Molecular Dynamics Simulations | Bertazzo, Martina; Bernetti, Mattia; Recanatini, Maurizio; Masetti, Matteo; Cavalli, Andrea | 2018-01-01 | JOURNAL OF CHEMICAL INFORMATION AND MODELING | - | 1.01 Articolo in rivista | - |
| Dynamic Docking: A Paradigm Shift in Computational Drug Discovery | Gioia, Dario; Bertazzo, Martina; Recanatini, Maurizio; Masetti, Matteo; Cavalli, Andrea | 2017-01-01 | MOLECULES | - | 1.01 Articolo in rivista | 2017_gioia_molecules.pdf |