ALBERGA, DOMENICO
ALBERGA, DOMENICO
Istituto di Cristallografia - IC
DeLA-DrugSelf: Empowering Multi-Objective De Novo Design through SELFIES Molecular Representation
2024 Alberga, Domenico; Lamanna, Giuseppe; Graziano, Giovanni; Delre, Pietro; Cristina Lomuscio, Maria; Corriero, Nicola; Ligresti, Alessia; Siliqi, Dritan; Saviano, Michele; Contino, Marialessandra; Stefanachi, Angela; Mangiatordi, GIUSEPPE FELICE
Molecular interactions between a diphenyl scaffold and PED/PEA15: Implications for type II diabetes therapeutics targeting PED/PEA15 - Phospholipase D1 interaction
2024 Mercurio, Ivan; D'Abrosca, Gianluca; Della Valle, Maria; Malgieri, Gaetano; Fattorusso, Roberto; Isernia, Carla; Russo, Luigi; Di Gaetano, Sonia; Pedone, Emilia Maria; Pirone, Luciano; Del Gatto, Annarita; Zaccaro, Laura; Alberga, Domenico; Saviano, Michele; Mangiatordi, Giuseppe Felice
SIGMAP: an explainable artificial intelligence tool for SIGMA-1 receptor affinity prediction
2024 Lomuscio, Maria Cristina; Corriero, Nicola; Nanna, Vittoria; Piccinno, Antonio; Saviano, Michele; Lanzilotti, Rosa; Abate, Carmen; Alberga, Domenico; Mangiatordi, Giuseppe Felice
ALPACA: A machine Learning Platform for Affinity and selectivity profiling of CAnnabinoids receptors modulators
2023 Delre, Pietro; Contino, Marialessandra; Alberga, Domenico; Saviano, Michele; Corriero, Nicola; Mangiatordi, GIUSEPPE FELICE
AMALPHI: A Machine Learning Platform for Predicting Drug-Induced PhospholIpidosis
2023 Lomuscio, MARIA CRISTINA; Abate, Carmen; Alberga, Domenico; Laghezza, Antonio; Corriero, Nicola; Colabufo Nicola, Antonio; Saviano, Michele; Delre, Pietro; Mangiatordi, GIUSEPPE FELICE
Structural Characterization of the Full-Length Anti-CD20 Antibody Rituximab
2022 Belviso, Bd; Mangiatordi, Gf; Alberga, D; Mangini, V; Carrozzini, B; Caliandro, R
CATMoS: Collaborative acute toxicity modeling suite
2021 Mansouri, Kamel; Karmaus Agnes, L; Fitzpatrick, Jeremy; Patlewicz, Grace; Pradeep, Prachi; Alberga, Domenico; Alepee, Nathalie; Allen Timothy, Eh; Allen, Dave; Alves Vinicius, M; Andrade Carolina, H; Auernhammer Tyler, R; Ballabio, Davide; Bell, Shannon; Benfenati, Emilio; Bhattacharya, Sudin; Bastos Joyce, V; Boyd, Stephen; Brown, J B; Capuzzi Stephen, J; Chushak, Yaroslav; Ciallella, Heather; Clark Alex, M; Consonni, Viviana; Daga Pankaj, R; Ekins, Sean; Farag, Sherif; Fedorov, Maxim; Fourches, Denis; Gadaleta, Domenico; Gao, Feng; Gearhart Jeffery, M; Goh, Garett; Goodman Jonathan, M; Grisoni, Francesca; Grulke Christopher, M; Hartung, Thomas; Hirn, Matthew; Karpov, Pavel; Korotcov, Alexandru; Lavado Giovanna, J; Lawless, Michael; Li, Xinhao; Luechtefeld, Thomas; Lunghini, Filippo; Mangiatordi Giuseppe, F; Marcou, Gilles; Marsh, Dan; Martin, Todd; Mauri, Andrea; Muratov Eugene, N; Myatt Glenn, J; Nguyen Dac, Trung; Nicolotti, Orazio; Note, Reine; Pande, Paritosh; Parks Amanda, K; Peryea, Tyler; Polash Ahsan, H; Rallo, Robert; Roncaglioni, Alessandra; Rowlands, Craig; Ruiz, Patricia; Russo Daniel, P; Sayed, Ahmed; Sayre, Risa; Sheils, Timothy; Siegel, Charles; Silva Arthur, C; Simeonov, Anton; Sosnin, Sergey; Southall, Noel; Strickland, Judy; Tang, Yun; Teppen, Brian; Tetko Igor, V; Thomas, Dennis; Tkachenko, Valery; Todeschini, Roberto; Toma, Cosimo; Tripodi, Ignacio; Trisciuzzi, Daniela; Tropsha, Alexander; Varnek, Alexandre; Vukovic, Kristijan; Wang, Zhongyu; Wang, Liguo; Waters Katrina, M; Wedlake Andrew, J; Wijeyesakere Sanjeeva, J; Wilson, Dan; Xiao, Zijun; Yang, Hongbin; Zahoranszkykohalmi, Gergely; Zakharov Alexey, V; Zhang Fagen, F; Zhang, Zhen; Zhao, Tongan; Zhu, Hao; Zorn Kimberley, M
Quantitative Polypharmacology Profiling Based on a Multifingerprint Similarity Predictive Approach
2021 Alberga, Domenico
Compara: Collaborative modeling project for androgen receptor activity
2020 Mansouri, K; Kleinstreuer, N; Abdelaziz, Am; Alberga, D; Alves, Vm; Andersson, Pl; Andrade, Ch; Bai, F; Balabin, I; Ballabio, D; Benfenati, E; Bhhatarai, B; Boyer, S; Chen, J; Consonni, V; Farag, S; Fourches, D; Garciasosa, At; Gramatica, P; Grisoni, F; Grulke, Cm; Hong, H; Horvath, D; Hu, X; Huang, R; Jeliazkova, N; Li, J; Li, X; Liu, H; Manganelli, S; Mangiatordi, Gf; Maran, U; Marcou, G; Martin, T; Muratov, E; Nguyen, Dt; Nicolotti, O; Nikolov, Ng; Norinder, U; Papa, E; Petitjean, M; Piir, G; Pogodin, P; Poroikov, V; Qiao, X; Richard, Am; Roncaglioni, A; Ruiz, P; Rupakheti, C; Sakkiah, S; Sangion, A; Schramm, Kw; Selvaraj, C; Shah, I; Sild, S; Sun, L; Taboureau, O; Tang, Y; Tetko, Iv; Todeschini, R; Tong, W; Trisciuzzi, D; Tropsha, A; Van Den Driessche, G; Varnek, A; Wang, Z; Wedebye, Eb; Williams, Aj; Xie, H; Zakharov, Av; Zheng, Z; Judson, Rs
De Novo Drug Design of Targeted Chemical Libraries Based on Artificial Intelligence and Pair-Based Multiobjective Optimization
2020 Alberga, Domenico; Gambacorta, Nicola; Trisciuzzi, Daniela; Ciriaco, Fulvio; Amoroso, Nicola; Nicolotti, Orazio
Enhancing the Sensitivity of Biotinylated Surfaces by Tailoring the Design of the Mixed Self-Assembled Monolayer Synthesis
2020 Blasi, Davide; Sarcina, Lucia; Tricase, Angelo; Stefanachi, Angela; Leonetti, Francesco; Alberga, Domenico; Mangiatordi, GIUSEPPE FELICE; Manoli, Kyriaki; Scamarcio, Gaetano; Picca Rosaria, Anna; Torsi, Luisa
Theoretical insights on acceptor-donor dyads for organic photovoltaics
2020 Turelli, Michele; Alberga, Domenico; Lattanzi, Gianluca; Ciofini, Ilaria; Adamo, Carlo
Exploring the role of elongation Factor-Like 1 (EFL1) in Shwachman-Diamond syndrome through molecular dynamics
2019 Delre, Pietro; Alberga, Domenico; Gijsbers, Abril; Sanchezpuig, Nuria; Nicolotti, Orazio; Saviano, Michele; Siliqi, Dritan; Mangiatordi, GIUSEPPE FELICE
| Titolo | Data di pubblicazione | Autore(i) | File |
|---|---|---|---|
| DeLA-DrugSelf: Empowering Multi-Objective De Novo Design through SELFIES Molecular Representation | 1-gen-2024 | Alberga, Domenico; Lamanna, Giuseppe; Graziano, Giovanni; Delre, Pietro; Cristina Lomuscio, Maria; Corriero, Nicola; Ligresti, Alessia; Siliqi, Dritan; Saviano, Michele; Contino, Marialessandra; Stefanachi, Angela; Mangiatordi, GIUSEPPE FELICE | |
| Molecular interactions between a diphenyl scaffold and PED/PEA15: Implications for type II diabetes therapeutics targeting PED/PEA15 - Phospholipase D1 interaction | 1-gen-2024 | Mercurio, Ivan; D'Abrosca, Gianluca; Della Valle, Maria; Malgieri, Gaetano; Fattorusso, Roberto; Isernia, Carla; Russo, Luigi; Di Gaetano, Sonia; Pedone, Emilia Maria; Pirone, Luciano; Del Gatto, Annarita; Zaccaro, Laura; Alberga, Domenico; Saviano, Michele; Mangiatordi, Giuseppe Felice | |
| SIGMAP: an explainable artificial intelligence tool for SIGMA-1 receptor affinity prediction | 1-gen-2024 | Lomuscio, Maria Cristina; Corriero, Nicola; Nanna, Vittoria; Piccinno, Antonio; Saviano, Michele; Lanzilotti, Rosa; Abate, Carmen; Alberga, Domenico; Mangiatordi, Giuseppe Felice | |
| ALPACA: A machine Learning Platform for Affinity and selectivity profiling of CAnnabinoids receptors modulators | 1-gen-2023 | Delre, Pietro; Contino, Marialessandra; Alberga, Domenico; Saviano, Michele; Corriero, Nicola; Mangiatordi, GIUSEPPE FELICE | |
| AMALPHI: A Machine Learning Platform for Predicting Drug-Induced PhospholIpidosis | 1-gen-2023 | Lomuscio, MARIA CRISTINA; Abate, Carmen; Alberga, Domenico; Laghezza, Antonio; Corriero, Nicola; Colabufo Nicola, Antonio; Saviano, Michele; Delre, Pietro; Mangiatordi, GIUSEPPE FELICE | |
| Structural Characterization of the Full-Length Anti-CD20 Antibody Rituximab | 1-gen-2022 | Belviso, Bd; Mangiatordi, Gf; Alberga, D; Mangini, V; Carrozzini, B; Caliandro, R | |
| CATMoS: Collaborative acute toxicity modeling suite | 1-gen-2021 | Mansouri, Kamel; Karmaus Agnes, L; Fitzpatrick, Jeremy; Patlewicz, Grace; Pradeep, Prachi; Alberga, Domenico; Alepee, Nathalie; Allen Timothy, Eh; Allen, Dave; Alves Vinicius, M; Andrade Carolina, H; Auernhammer Tyler, R; Ballabio, Davide; Bell, Shannon; Benfenati, Emilio; Bhattacharya, Sudin; Bastos Joyce, V; Boyd, Stephen; Brown, J B; Capuzzi Stephen, J; Chushak, Yaroslav; Ciallella, Heather; Clark Alex, M; Consonni, Viviana; Daga Pankaj, R; Ekins, Sean; Farag, Sherif; Fedorov, Maxim; Fourches, Denis; Gadaleta, Domenico; Gao, Feng; Gearhart Jeffery, M; Goh, Garett; Goodman Jonathan, M; Grisoni, Francesca; Grulke Christopher, M; Hartung, Thomas; Hirn, Matthew; Karpov, Pavel; Korotcov, Alexandru; Lavado Giovanna, J; Lawless, Michael; Li, Xinhao; Luechtefeld, Thomas; Lunghini, Filippo; Mangiatordi Giuseppe, F; Marcou, Gilles; Marsh, Dan; Martin, Todd; Mauri, Andrea; Muratov Eugene, N; Myatt Glenn, J; Nguyen Dac, Trung; Nicolotti, Orazio; Note, Reine; Pande, Paritosh; Parks Amanda, K; Peryea, Tyler; Polash Ahsan, H; Rallo, Robert; Roncaglioni, Alessandra; Rowlands, Craig; Ruiz, Patricia; Russo Daniel, P; Sayed, Ahmed; Sayre, Risa; Sheils, Timothy; Siegel, Charles; Silva Arthur, C; Simeonov, Anton; Sosnin, Sergey; Southall, Noel; Strickland, Judy; Tang, Yun; Teppen, Brian; Tetko Igor, V; Thomas, Dennis; Tkachenko, Valery; Todeschini, Roberto; Toma, Cosimo; Tripodi, Ignacio; Trisciuzzi, Daniela; Tropsha, Alexander; Varnek, Alexandre; Vukovic, Kristijan; Wang, Zhongyu; Wang, Liguo; Waters Katrina, M; Wedlake Andrew, J; Wijeyesakere Sanjeeva, J; Wilson, Dan; Xiao, Zijun; Yang, Hongbin; Zahoranszkykohalmi, Gergely; Zakharov Alexey, V; Zhang Fagen, F; Zhang, Zhen; Zhao, Tongan; Zhu, Hao; Zorn Kimberley, M | |
| Quantitative Polypharmacology Profiling Based on a Multifingerprint Similarity Predictive Approach | 1-gen-2021 | Alberga, Domenico | |
| Compara: Collaborative modeling project for androgen receptor activity | 1-gen-2020 | Mansouri, K; Kleinstreuer, N; Abdelaziz, Am; Alberga, D; Alves, Vm; Andersson, Pl; Andrade, Ch; Bai, F; Balabin, I; Ballabio, D; Benfenati, E; Bhhatarai, B; Boyer, S; Chen, J; Consonni, V; Farag, S; Fourches, D; Garciasosa, At; Gramatica, P; Grisoni, F; Grulke, Cm; Hong, H; Horvath, D; Hu, X; Huang, R; Jeliazkova, N; Li, J; Li, X; Liu, H; Manganelli, S; Mangiatordi, Gf; Maran, U; Marcou, G; Martin, T; Muratov, E; Nguyen, Dt; Nicolotti, O; Nikolov, Ng; Norinder, U; Papa, E; Petitjean, M; Piir, G; Pogodin, P; Poroikov, V; Qiao, X; Richard, Am; Roncaglioni, A; Ruiz, P; Rupakheti, C; Sakkiah, S; Sangion, A; Schramm, Kw; Selvaraj, C; Shah, I; Sild, S; Sun, L; Taboureau, O; Tang, Y; Tetko, Iv; Todeschini, R; Tong, W; Trisciuzzi, D; Tropsha, A; Van Den Driessche, G; Varnek, A; Wang, Z; Wedebye, Eb; Williams, Aj; Xie, H; Zakharov, Av; Zheng, Z; Judson, Rs | |
| 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 | |
| Enhancing the Sensitivity of Biotinylated Surfaces by Tailoring the Design of the Mixed Self-Assembled Monolayer Synthesis | 1-gen-2020 | Blasi, Davide; Sarcina, Lucia; Tricase, Angelo; Stefanachi, Angela; Leonetti, Francesco; Alberga, Domenico; Mangiatordi, GIUSEPPE FELICE; Manoli, Kyriaki; Scamarcio, Gaetano; Picca Rosaria, Anna; Torsi, Luisa | |
| Theoretical insights on acceptor-donor dyads for organic photovoltaics | 1-gen-2020 | Turelli, Michele; Alberga, Domenico; Lattanzi, Gianluca; Ciofini, Ilaria; Adamo, Carlo | |
| Exploring the role of elongation Factor-Like 1 (EFL1) in Shwachman-Diamond syndrome through molecular dynamics | 1-gen-2019 | Delre, Pietro; Alberga, Domenico; Gijsbers, Abril; Sanchezpuig, Nuria; Nicolotti, Orazio; Saviano, Michele; Siliqi, Dritan; Mangiatordi, GIUSEPPE FELICE |