ALBERGA, DOMENICO
ALBERGA, DOMENICO
A New Approach for Drug Target and Bioactivity Prediction: The Multifingerprint Similarity Search Algorithm (MuSSeL)
2019-01-01 Alberga, Domenico; Trisciuzzi, Daniela; Montaruli, Michele; Leonetti, Francesco; Mangiatordi, Giuseppe Felice; Nicolotti, Orazio
A rational approach to elucidate human monoamine oxidase molecular selectivity
2017-01-01 Mangiatordi, Giuseppe Felice; Alberga, Domenico; Pisani, Leonardo; Gadaleta, Domenico; Trisciuzzi, Daniela; Farina, Roberta; Carotti, A; Lattanzi, G; Catto, Marco; Nicolotti, Orazio
Accelerating drug discovery by early protein drug target prediction based on a multi-fingerprint similarity search †
2019-01-01 Montaruli, M.; Alberga, D.; Ciriaco, F.; Trisciuzzi, D.; Tondo, A. R.; Mangiatordi, G. F.; Nicolotti, O.
Automated identification of structurally heterogeneous and patentable antiproliferative hits as potential tubulin inhibitors
2018-01-01 Mangiatordi, G. F.; Trisciuzzi, D.; Iacobazzi, R.; Denora, N.; Pisani, L.; Catto, M.; Leonetti, F.; Alberga, D.; Nicolotti, O.
Challenging AQP4 druggability for NMO-IgG antibody binding using molecular dynamics and molecular interaction fields
2015-01-01 Mangiatordi, Giuseppe Felice; Alberga, Domenico; Siragusa, Lydia; Goracci, Laura; Lattanzi, Gianluca; Nicolotti, Orazio
ClC-1 mutations in myotonia congenita patients: insights into molecular gating mechanisms and genotype-phenotype correlation
2015-01-01 Imbrici, P; Maggi, L; Mangiatordi, G F; Dinardo, M M; Altamura, Concetta; Brugnoni, R; Alberga, D; Pinter, G L; Ricci, G; Siciliano, G; Micheli, R; Annicchiarico, G; Lattanzi, G; Nicolotti, O; Morandi, L; Bernasconi, P; Desaphy, J-F; Mantegazza, R; Camerino, D C
Compara: Collaborative modeling project for androgen receptor activity
2020-01-01 Mansouri, K.; Kleinstreuer, N.; Abdelaziz, A. M.; Alberga, D.; Alves, V. M.; Andersson, P. L.; Andrade, C. H.; Bai, F.; Balabin, I.; Ballabio, D.; Benfenati, E.; Bhhatarai, B.; Boyer, S.; Chen, J.; Consonni, V.; Farag, S.; Fourches, D.; Garcia-Sosa, A. T.; Gramatica, P.; Grisoni, F.; Grulke, C. M.; Hong, H.; Horvath, D.; Hu, X.; Huang, R.; Jeliazkova, N.; Li, J.; Li, X.; Liu, H.; Manganelli, S.; Mangiatordi, G. F.; Maran, U.; Marcou, G.; Martin, T.; Muratov, E.; Nguyen, D. -T.; Nicolotti, O.; Nikolov, N. G.; Norinder, U.; Papa, E.; Petitjean, M.; Piir, G.; Pogodin, P.; Poroikov, V.; Qiao, X.; Richard, A. M.; Roncaglioni, A.; Ruiz, P.; Rupakheti, C.; Sakkiah, S.; Sangion, A.; Schramm, K. -W.; Selvaraj, C.; Shah, I.; Sild, S.; Sun, L.; Taboureau, O.; Tang, Y.; Tetko, I. V.; Todeschini, R.; Tong, W.; Trisciuzzi, D.; Tropsha, A.; Van Den Driessche, G.; Varnek, A.; Wang, Z.; Wedebye, E. B.; Williams, A. J.; Xie, H.; Zakharov, A. V.; Zheng, Z.; Judson, R. S.
De Novo Drug Design of Targeted Chemical Libraries Based on Artificial Intelligence and Pair-Based Multiobjective Optimization
2020-01-01 Alberga, Domenico; Gambacorta, Nicola; Trisciuzzi, Daniela; Ciriaco, Fulvio; Amoroso, Nicola; Nicolotti, Orazio
Design, Synthesis, and Biological Evaluation of Tetrahydro-β-carboline Derivatives as Selective Sub-Nanomolar Gelatinase Inhibitors
2018-01-01 Mangiatordi, Giuseppe Felice; Guzzo, Tatiana; Rossano, Eugenio Claudio; Trisciuzzi, Daniela; Alberga, Domenico; Fasciglione, Giovanni; Coletta, Massimiliano; Topai, Alessandra; Nicolotti, Orazio
Design, synthesis, biological evaluation, NMR and DFT studies of structurally-simplified trimethoxy benzamides as P-glycoprotein selective inhibitors: the role of molecular flatness
2016-01-01 Stefanachi, Angela; Mangiatordi, Giuseppe Felice; Tardia, Piero; Alberga, Domenico; Leonetti, Francesco; Niso, Mauro; Colabufo, Nicola Antonio; Adamo, Carlo; Nicolotti, Orazio; Cellamare, Saverio
Docking-based classification models for exploratory toxicology studies on high-quality estrogenic experimental data
2015-01-01 Trisciuzzi, Daniela; Alberga, Domenico; Mansouri, K; Judson, R; Cellamare, Saverio; Catto, Marco; Carotti, Angelo; Benfenati, E; Novellino, E; Mangiatordi, Giuseppe Felice; Nicolotti, Orazio
Effects of Different Self-Assembled Monolayers on Thin-Film Morphology: A Combined DFT/MD Simulation Protocol
2015-01-01 Alberga, Domenico; Mangiatordi, Giuseppe Felice; Motta, Alessandro; Nicolotti, Orazio; Lattanzi, Gianluca
Enhancing the Sensitivity of Biotinylated Surfaces by Tailoring the Design of the Mixed Self-Assembled Monolayer Synthesis
2020-01-01 Blasi, D.; Sarcina, L.; Tricase, A.; Stefanachi, A.; Leonetti, F.; Alberga, D.; Mangiatordi, G. F.; Manoli, K.; Scamarcio, G.; Picca, R. A.; Torsi, L.
Exploring the role of elongation Factor-Like 1 (EFL1) in Shwachman-Diamond syndrome through molecular dynamics
2019-01-01 Delre, P.; Alberga, D.; Gijsbers, A.; Sanchez-Puig, N.; Nicolotti, O.; Saviano, M.; Siliqi, D.; Mangiatordi, G. F.
Human aquaporin-4 and molecular modeling: Historical perspective and view to the future
2016-01-01 Mangiatordi, Giuseppe Felice; Alberga, Domenico; Trisciuzzi, Daniela; Lattanzi, Gianluca; Nicolotti, Orazio
Identification of a point mutation impairing the binding between aquaporin-4 and neuromyelitis optica Autoantibodies
2014-01-01 Pisani, Francesco; Mola, Maria Grazia; Simone, Laura; Rosito, Stefania; Alberga, Domenico; Mangiatordi, Giuseppe Felice; Lattanzi, Gianluca; Nicolotti, Orazio; Frigeri, Antonio; Svelto, Maria; Nicchia, GRAZIA PAOLA
Mind the Gap ! A Journey towards Computational Toxicology
2016-01-01 Mangiatordi, Giuseppe Felice; Alberga, Domenico; Altomare, Cosimo Damiano; Carotti, Angelo; Catto, Marco; Cellamare, Saverio; Gadaleta, Domenico; Lattanzi, Gianluca; Leonetti, Francesco; Pisani, Leonardo; Stefanachi, Angela; Trisciuzzi, Daniela; Nicolotti, Orazio
Molecular docking for predictive toxicology
2018-01-01 Trisciuzzi, Daniela; Alberga, Domenico; Leonetti, Francesco; Novellino, Ettore; Nicolotti, Orazio; Mangiatordi, Giuseppe F.
Morphological and charge transport properties of amorphous and crystalline P3HT and PBTTT: Insights from theory
2015-01-01 Alberga, Domenico; Perrier, Aurélie; Ciofini, Ilaria; Mangiatordi, Giuseppe Felice; Lattanzi, Gianluca; Adamo, Carlo
Multidisciplinary study of a new ClC-1 mutation causing myotonia congenita: a paradigm to understand and treat ion channelopathies
2016-01-01 Imbrici, Paola; Altamura, Concetta; Camerino, GIULIA MARIA; Mangiatordi, Giuseppe Felice; Conte, Elena; Maggi, Lorenzo; Brugnoni, Raffaella; Musaraj, Kejla; Caloiero, Roberta; Alberga, Domenico; Marsano, RENE' MASSIMILIANO; Ricci, Giulia; Siciliano, Gabriele; Nicolotti, Orazio; Mora, Marina; Bernasconi, Pia; Desaphy, Jean Francois; Mantegazza, Renato; Conte, Diana
| Titolo | Data di pubblicazione | Autore(i) | File |
|---|---|---|---|
| A New Approach for Drug Target and Bioactivity Prediction: The Multifingerprint Similarity Search Algorithm (MuSSeL) | 1-gen-2019 | Alberga, Domenico; Trisciuzzi, Daniela; Montaruli, Michele; Leonetti, Francesco; Mangiatordi, Giuseppe Felice; Nicolotti, Orazio | |
| A rational approach to elucidate human monoamine oxidase molecular selectivity | 1-gen-2017 | Mangiatordi, Giuseppe Felice; Alberga, Domenico; Pisani, Leonardo; Gadaleta, Domenico; Trisciuzzi, Daniela; Farina, Roberta; Carotti, A; Lattanzi, G; Catto, Marco; Nicolotti, Orazio | |
| Accelerating drug discovery by early protein drug target prediction based on a multi-fingerprint similarity search † | 1-gen-2019 | Montaruli, M.; Alberga, D.; Ciriaco, F.; Trisciuzzi, D.; Tondo, A. R.; Mangiatordi, G. F.; Nicolotti, O. | |
| Automated identification of structurally heterogeneous and patentable antiproliferative hits as potential tubulin inhibitors | 1-gen-2018 | Mangiatordi, G. F.; Trisciuzzi, D.; Iacobazzi, R.; Denora, N.; Pisani, L.; Catto, M.; Leonetti, F.; Alberga, D.; Nicolotti, O. | |
| Challenging AQP4 druggability for NMO-IgG antibody binding using molecular dynamics and molecular interaction fields | 1-gen-2015 | Mangiatordi, Giuseppe Felice; Alberga, Domenico; Siragusa, Lydia; Goracci, Laura; Lattanzi, Gianluca; Nicolotti, Orazio | |
| ClC-1 mutations in myotonia congenita patients: insights into molecular gating mechanisms and genotype-phenotype correlation | 1-gen-2015 | Imbrici, P; Maggi, L; Mangiatordi, G F; Dinardo, M M; Altamura, Concetta; Brugnoni, R; Alberga, D; Pinter, G L; Ricci, G; Siciliano, G; Micheli, R; Annicchiarico, G; Lattanzi, G; Nicolotti, O; Morandi, L; Bernasconi, P; Desaphy, J-F; Mantegazza, R; Camerino, D C | |
| Compara: Collaborative modeling project for androgen receptor activity | 1-gen-2020 | Mansouri, K.; Kleinstreuer, N.; Abdelaziz, A. M.; Alberga, D.; Alves, V. M.; Andersson, P. L.; Andrade, C. H.; Bai, F.; Balabin, I.; Ballabio, D.; Benfenati, E.; Bhhatarai, B.; Boyer, S.; Chen, J.; Consonni, V.; Farag, S.; Fourches, D.; Garcia-Sosa, A. T.; Gramatica, P.; Grisoni, F.; Grulke, C. M.; Hong, H.; Horvath, D.; Hu, X.; Huang, R.; Jeliazkova, N.; Li, J.; Li, X.; Liu, H.; Manganelli, S.; Mangiatordi, G. F.; Maran, U.; Marcou, G.; Martin, T.; Muratov, E.; Nguyen, D. -T.; Nicolotti, O.; Nikolov, N. G.; Norinder, U.; Papa, E.; Petitjean, M.; Piir, G.; Pogodin, P.; Poroikov, V.; Qiao, X.; Richard, A. M.; Roncaglioni, A.; Ruiz, P.; Rupakheti, C.; Sakkiah, S.; Sangion, A.; Schramm, K. -W.; Selvaraj, C.; Shah, I.; Sild, S.; Sun, L.; Taboureau, O.; Tang, Y.; Tetko, I. V.; Todeschini, R.; Tong, W.; Trisciuzzi, D.; Tropsha, A.; Van Den Driessche, G.; Varnek, A.; Wang, Z.; Wedebye, E. B.; Williams, A. J.; Xie, H.; Zakharov, A. V.; Zheng, Z.; Judson, R. S. | |
| De Novo Drug Design of Targeted Chemical Libraries Based on Artificial Intelligence and Pair-Based Multiobjective Optimization | 1-gen-2020 | Alberga, Domenico; Gambacorta, Nicola; Trisciuzzi, Daniela; Ciriaco, Fulvio; Amoroso, Nicola; Nicolotti, Orazio | |
| Design, Synthesis, and Biological Evaluation of Tetrahydro-β-carboline Derivatives as Selective Sub-Nanomolar Gelatinase Inhibitors | 1-gen-2018 | Mangiatordi, Giuseppe Felice; Guzzo, Tatiana; Rossano, Eugenio Claudio; Trisciuzzi, Daniela; Alberga, Domenico; Fasciglione, Giovanni; Coletta, Massimiliano; Topai, Alessandra; Nicolotti, Orazio | |
| Design, synthesis, biological evaluation, NMR and DFT studies of structurally-simplified trimethoxy benzamides as P-glycoprotein selective inhibitors: the role of molecular flatness | 1-gen-2016 | Stefanachi, Angela; Mangiatordi, Giuseppe Felice; Tardia, Piero; Alberga, Domenico; Leonetti, Francesco; Niso, Mauro; Colabufo, Nicola Antonio; Adamo, Carlo; Nicolotti, Orazio; Cellamare, Saverio | |
| Docking-based classification models for exploratory toxicology studies on high-quality estrogenic experimental data | 1-gen-2015 | Trisciuzzi, Daniela; Alberga, Domenico; Mansouri, K; Judson, R; Cellamare, Saverio; Catto, Marco; Carotti, Angelo; Benfenati, E; Novellino, E; Mangiatordi, Giuseppe Felice; Nicolotti, Orazio | |
| Effects of Different Self-Assembled Monolayers on Thin-Film Morphology: A Combined DFT/MD Simulation Protocol | 1-gen-2015 | Alberga, Domenico; Mangiatordi, Giuseppe Felice; Motta, Alessandro; Nicolotti, Orazio; Lattanzi, Gianluca | |
| Enhancing the Sensitivity of Biotinylated Surfaces by Tailoring the Design of the Mixed Self-Assembled Monolayer Synthesis | 1-gen-2020 | Blasi, D.; Sarcina, L.; Tricase, A.; Stefanachi, A.; Leonetti, F.; Alberga, D.; Mangiatordi, G. F.; Manoli, K.; Scamarcio, G.; Picca, R. A.; Torsi, L. | |
| Exploring the role of elongation Factor-Like 1 (EFL1) in Shwachman-Diamond syndrome through molecular dynamics | 1-gen-2019 | Delre, P.; Alberga, D.; Gijsbers, A.; Sanchez-Puig, N.; Nicolotti, O.; Saviano, M.; Siliqi, D.; Mangiatordi, G. F. | |
| Human aquaporin-4 and molecular modeling: Historical perspective and view to the future | 1-gen-2016 | Mangiatordi, Giuseppe Felice; Alberga, Domenico; Trisciuzzi, Daniela; Lattanzi, Gianluca; Nicolotti, Orazio | |
| Identification of a point mutation impairing the binding between aquaporin-4 and neuromyelitis optica Autoantibodies | 1-gen-2014 | Pisani, Francesco; Mola, Maria Grazia; Simone, Laura; Rosito, Stefania; Alberga, Domenico; Mangiatordi, Giuseppe Felice; Lattanzi, Gianluca; Nicolotti, Orazio; Frigeri, Antonio; Svelto, Maria; Nicchia, GRAZIA PAOLA | |
| Mind the Gap ! A Journey towards Computational Toxicology | 1-gen-2016 | Mangiatordi, Giuseppe Felice; Alberga, Domenico; Altomare, Cosimo Damiano; Carotti, Angelo; Catto, Marco; Cellamare, Saverio; Gadaleta, Domenico; Lattanzi, Gianluca; Leonetti, Francesco; Pisani, Leonardo; Stefanachi, Angela; Trisciuzzi, Daniela; Nicolotti, Orazio | |
| Molecular docking for predictive toxicology | 1-gen-2018 | Trisciuzzi, Daniela; Alberga, Domenico; Leonetti, Francesco; Novellino, Ettore; Nicolotti, Orazio; Mangiatordi, Giuseppe F. | |
| Morphological and charge transport properties of amorphous and crystalline P3HT and PBTTT: Insights from theory | 1-gen-2015 | Alberga, Domenico; Perrier, Aurélie; Ciofini, Ilaria; Mangiatordi, Giuseppe Felice; Lattanzi, Gianluca; Adamo, Carlo | |
| Multidisciplinary study of a new ClC-1 mutation causing myotonia congenita: a paradigm to understand and treat ion channelopathies | 1-gen-2016 | Imbrici, Paola; Altamura, Concetta; Camerino, GIULIA MARIA; Mangiatordi, Giuseppe Felice; Conte, Elena; Maggi, Lorenzo; Brugnoni, Raffaella; Musaraj, Kejla; Caloiero, Roberta; Alberga, Domenico; Marsano, RENE' MASSIMILIANO; Ricci, Giulia; Siciliano, Gabriele; Nicolotti, Orazio; Mora, Marina; Bernasconi, Pia; Desaphy, Jean Francois; Mantegazza, Renato; Conte, Diana |