RECANATINI, MAURIZIO
RECANATINI, MAURIZIO
DIPARTIMENTO DI FARMACIA E BIOTECNOLOGIE
Innovative Strategy toward Mutant CFTR Rescue in Cystic Fibrosis: Design and Synthesis of Thiadiazole Inhibitors of the E3 Ligase RNF5
2023 Brusa, Irene; Sondo, Elvira; Pesce, Emanuela; Tomati, Valeria; Gioia, Dario; Falchi, Federico; Balboni, Beatrice; Ortega Martínez, Jose Antonio; Veronesi, Marina; Romeo, Elisa; Margaroli, Natasha; Recanatini, Maurizio; Girotto, Stefania; Pedemonte, Nicoletta; Roberti, Marinella; Cavalli, Andrea
Network modeling helps to tackle the complexity of drug-disease systems
2023 Recanatini, Maurizio; Menestrina, Luca
An unsupervised computational pipeline identifies potential repurposable drugs to treat Huntington's disease and multiple sclerosis
2022 Menestrina, Luca; Recanatini, Maurizio
Computational drug discovery under RNA times
2022 Bernetti M.; Aguti R.; Bosio S.; Recanatini M.; Masetti M.; Cavalli A.
COVIDrugNet: a network-based web tool to investigate the drugs currently in clinical trial to contrast COVID-19
2021 Menestrina L.; Cabrelle C.; Recanatini M.
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
Targeting the JAK/STAT Pathway: A Combined Ligand- And Target-Based Approach
2021 Galvez-Llompart M.; Ocello R.; Rullo L.; Stamatakos S.; Alessandrini I.; Zanni R.; Tunon I.; Cavalli A.; Candeletti S.; Masetti M.; Romualdi P.; Recanatini M.
Drug Research Meets Network Science: Where Are We?
2020 Recanatini, Maurizio; Cabrelle, Chiara
Exploring Conformational Dynamics of the Extracellular Venus flytrap Domain of the GABAB Receptor: A Path-Metadynamics Study
2020 Evenseth, Linn S M; Ocello, Riccardo; Gabrielsen, Mari; Masetti, Matteo; Recanatini, Maurizio; Sylte, Ingebrigt; Cavalli, Andrea
Multi-target dopamine D3 receptor modulators: Actionable knowledge for drug design from molecular dynamics and machine learning
2020 Ferraro M.; Decherchi S.; De Simone A.; Recanatini M.; Cavalli A.; Bottegoni G.
Targeting the Protein Tunnels of the Urease Accessory Complex: A Theoretical Investigation
2020 Masetti, Matteo; Falchi, Federico; Gioia, Dario; Recanatini, Maurizio; Ciurli, Stefano; Musiani, Francesco
An Integrated Markov State Model and Path Metadynamics Approach to Characterize Drug Binding Processes
2019 Bernetti M.; Masetti M.; Recanatini M.; Amaro R.E.; Cavalli A.
Characterisation of bioactive compounds in wine by-products: toward the valorisation of sustainable resources
2019 Camilla Marasca, Irene Brusa, Chiara Cabrelle, Michele Protti, Matteo Micucci, Laura Mercolini, Marinella Roberti, Roberta Budriesi, Maurizio Recanatini
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
Binding Residence Time through Scaled Molecular Dynamics: A Prospective Application to hDAAO Inhibitors
2018 Bernetti, Mattia; Rosini, Elena; Mollica, Luca; Masetti, Matteo; Pollegioni, Loredano; Recanatini, Maurizio; Cavalli, Andrea
Fully Flexible Docking via Reaction-Coordinate-Independent Molecular Dynamics Simulations
2018 Bertazzo, Martina; Bernetti, Mattia; Recanatini, Maurizio; Masetti, Matteo; Cavalli, Andrea
How dynamic docking simulations can help to tackle tough drug targets
2018 Recanatini M.
Development of a multisite model for Ni(II) ion in solution from thermodynamic and kinetic data
2017 Masetti, Matteo; Musiani, Francesco; Bernetti, Mattia; Falchi, Federico; Cavalli, Andrea; Ciurli, Stefano; Recanatini, Maurizio
Dynamic Docking: A Paradigm Shift in Computational Drug Discovery
2017 Gioia, Dario; Bertazzo, Martina; Recanatini, Maurizio; Masetti, Matteo; Cavalli, Andrea
Lactate dehydrogenase inhibitors can reverse inflammation induced changes in colon cancer cells
2017 Manerba, Marcella; Di Ianni, Lorenza; Govoni, Marzia; Roberti, Marinella; Recanatini, Maurizio; Di Stefano, Giuseppina
| Titolo | Autore(i) | Anno | Periodico | Editore | Tipo | File |
|---|---|---|---|---|---|---|
| Innovative Strategy toward Mutant CFTR Rescue in Cystic Fibrosis: Design and Synthesis of Thiadiazole Inhibitors of the E3 Ligase RNF5 | Brusa, Irene; Sondo, Elvira; Pesce, Emanuela; Tomati, Valeria; Gioia, Dario; Falchi, Federico; Ba...lboni, Beatrice; Ortega Martínez, Jose Antonio; Veronesi, Marina; Romeo, Elisa; Margaroli, Natasha; Recanatini, Maurizio; Girotto, Stefania; Pedemonte, Nicoletta; Roberti, Marinella; Cavalli, Andrea | 2023-01-01 | JOURNAL OF MEDICINAL CHEMISTRY | - | 1.01 Articolo in rivista | brusa-et-al-2023-innovative-strategy-toward-mutant-cftr-rescue-in-cystic-fibrosis-design-and-synthesis-of-thiadiazole.pdf |
| Network modeling helps to tackle the complexity of drug-disease systems | Recanatini, Maurizio; Menestrina, Luca | 2023-01-01 | WIRES MECHANISMS OF DISEASE | - | 1.01 Articolo in rivista | Recanatini2023.pdf |
| An unsupervised computational pipeline identifies potential repurposable drugs to treat Huntington's disease and multiple sclerosis | Menestrina, Luca; Recanatini, Maurizio | 2022-01-01 | ARTIFICIAL INTELLIGENCE IN THE LIFE SCIENCES | - | 1.01 Articolo in rivista | Recanatini2022.pdf |
| Computational drug discovery under RNA times | Bernetti M.; Aguti R.; Bosio S.; Recanatini M.; Masetti M.; Cavalli A. | 2022-01-01 | QRB DISCOVERY | - | 1.01 Articolo in rivista | 2022_Bernetti.pdf |
| COVIDrugNet: a network-based web tool to investigate the drugs currently in clinical trial to contrast COVID-19 | Menestrina L.; Cabrelle C.; Recanatini M. | 2021-01-01 | SCIENTIFIC REPORTS | - | 1.01 Articolo in rivista | Recanatini2021_CoV.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 | - |
| Targeting the JAK/STAT Pathway: A Combined Ligand- And Target-Based Approach | Galvez-Llompart M.; Ocello R.; Rullo L.; Stamatakos S.; Alessandrini I.; Zanni R.; Tunon I.; Cava...lli A.; Candeletti S.; Masetti M.; Romualdi P.; Recanatini M. | 2021-01-01 | JOURNAL OF CHEMICAL INFORMATION AND MODELING | - | 1.01 Articolo in rivista | acs.jcim.2021_1.pdf |
| Drug Research Meets Network Science: Where Are We? | Recanatini, Maurizio; Cabrelle, Chiara | 2020-01-01 | JOURNAL OF MEDICINAL CHEMISTRY | - | 1.01 Articolo in rivista | Recanatini2020.pdf |
| Exploring Conformational Dynamics of the Extracellular Venus flytrap Domain of the GABAB Receptor: A Path-Metadynamics Study | Evenseth, Linn S M; Ocello, Riccardo; Gabrielsen, Mari; Masetti, Matteo; Recanatini, Maurizio; Sy...lte, Ingebrigt; Cavalli, Andrea | 2020-01-01 | JOURNAL OF CHEMICAL INFORMATION AND MODELING | - | 1.01 Articolo in rivista | 2020_evenseth_ocello_OPEN-ACCESS.pdf |
| Multi-target dopamine D3 receptor modulators: Actionable knowledge for drug design from molecular dynamics and machine learning | Ferraro M.; Decherchi S.; De Simone A.; Recanatini M.; Cavalli A.; Bottegoni G. | 2020-01-01 | EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY | - | 1.01 Articolo in rivista | - |
| Targeting the Protein Tunnels of the Urease Accessory Complex: A Theoretical Investigation | Masetti, Matteo; Falchi, Federico; Gioia, Dario; Recanatini, Maurizio; Ciurli, Stefano; Musiani, ...Francesco | 2020-01-01 | MOLECULES | - | 1.01 Articolo in rivista | 63_2020_Masetti_Molecules.pdf |
| An Integrated Markov State Model and Path Metadynamics Approach to Characterize Drug Binding Processes | Bernetti M.; Masetti M.; Recanatini M.; Amaro R.E.; Cavalli A. | 2019-01-01 | JOURNAL OF CHEMICAL THEORY AND COMPUTATION | - | 1.01 Articolo in rivista | - |
| Characterisation of bioactive compounds in wine by-products: toward the valorisation of sustainable resources | Camilla Marasca, Irene Brusa, Chiara Cabrelle, Michele Protti, Matteo Micucci, Laura Mercolini, M...arinella Roberti, Roberta Budriesi, Maurizio Recanatini | 2019-01-01 | - | - | 4.01 Contributo in Atti di convegno | - |
| 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 | - |
| Binding Residence Time through Scaled Molecular Dynamics: A Prospective Application to hDAAO Inhibitors | Bernetti, Mattia; Rosini, Elena; Mollica, Luca; Masetti, Matteo; Pollegioni, Loredano; Recanatini..., Maurizio; Cavalli, Andrea | 2018-01-01 | 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 | - |
| How dynamic docking simulations can help to tackle tough drug targets | Recanatini M. | 2018-01-01 | FUTURE MEDICINAL CHEMISTRY | - | 1.04 Replica / breve intervento (e simili) | - |
| Development of a multisite model for Ni(II) ion in solution from thermodynamic and kinetic data | Masetti, Matteo; Musiani, Francesco; Bernetti, Mattia; Falchi, Federico; Cavalli, Andrea; Ciurli,... Stefano; Recanatini, Maurizio | 2017-01-01 | JOURNAL OF COMPUTATIONAL CHEMISTRY | - | 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 |
| Lactate dehydrogenase inhibitors can reverse inflammation induced changes in colon cancer cells | Manerba, Marcella; Di Ianni, Lorenza; Govoni, Marzia; Roberti, Marinella; Recanatini, Maurizio; D...i Stefano, Giuseppina | 2017-01-01 | EUROPEAN JOURNAL OF PHARMACEUTICAL SCIENCES | - | 1.01 Articolo in rivista | manerba_2107.pdf |