CIANCETTA, Antonella
CIANCETTA, Antonella
Dipartimento di Scienze chimiche, farmaceutiche ed agrarie
2-Arylpyrazolo[4,3-d]pyrimidin-7-amino derivatives as new potent and selective human A3 adenosine receptor antagonists. Molecular modeling studies and pharmacological evaluation
file con accesso da definire2013 Squarcialupi, L.; Colotta, V.; Catarzi, D.; Varano, F.; Filacchioni, G.; Varani, Katia; Corciulo, Carmen; Vincenzi, Fabrizio; Borea, Pier Andrea; Ghelardini, C.; Di Cesare Mannelli, L.; Ciancetta, A.; Moro, S.
5,7-Disubstituted-[1,2,4]triazolo[1,5-a][1,3,5]triazines as pharmacological tools to explore the antagonist selectivity profiles toward adenosine receptors
2016 Federico, Stephanie; Ciancetta, Antonella; Porta, Nicola; Redenti, Sara; Pastorin, Giorgia; Cacciari, Barbara; Klotz, Karl Norbert; Moro, Stefano; Spalluto, Giampiero
7-Amino-2-phenylpyrazolo[4,3-d]pyrimidine derivatives: Structural investigations at the 5-position to target human A(1) and A(2A) adenosine receptors. Molecular modeling and pharmacological studies
2014 Squarcialupi, L; Colotta, V; Catarzi, D; Varano, F; Betti, M; Varani, Katia; Vincenzi, Fabrizio; Borea, Pier Andrea; Porta, N; Ciancetta, A; Moro, S.
A 2a adenosine receptor: Structures, modeling, and medicinal chemistry
2018 Baraldi, S.; Baraldi, P. G.; Oliva, P.; Toti, K. S.; Ciancetta, A.; Jacobson, K. A.
A QM/MM study of the binding of RAPTA ligands to cathepsin B
file con accesso da definire2011 Ciancetta, A; Genheden, S; Ryde, U
A3 adenosine receptor activation mechanisms: molecular dynamics analysis of inactive, active, and fully active states
2019 Ciancetta, A.; Rubio, P.; Lieberman, D. I.; Jacobson, K. A.
A3 Adenosine Receptors as Modulators of Inflammation: From Medicinal Chemistry to Therapy
2018 Jacobson, Ka; Merighi, Stefania; Varani, Katia; Borea, Pier Andrea; Baraldi, Stefania; AGHAZADEH TABRIZI, Mojgan; Romagnoli, Romeo; Baraldi, Pier Giovanni; Ciancetta, A; Tosh, Dk; Gao, Zg; Gessi, Stefania
Activation of Carboplatin by Carbonate
file con accesso da definire2012 Ciancetta, A; Coletti, C; Marrone, A; Re, N
Activation of carboplatin by chloride ions: a theoretical investigation
file con accesso da definire2011 Ciancetta, Antonella; Coletti, Cecilia; Marrone, Alessandro; Re, Nazzareno
Advances in Computational Techniques to Study GPCR-Ligand Recognition
file con accesso da definire2015 Ciancetta, A; Sabbadin, D; Federico, S; Spalluto, G; Moro, S
Advances in GPCR modeling evaluated by the GPCR Dock 2013 assessment: Meeting new challenges
file con accesso da definire2014 Kufareva, I.; Katritch, V.; Biggin, P.; Kim, M.; Park, K.; Jung, S. W.; Cho, A. E.; Sands, Z. A.; Ostopovici-Halip, L.; Bologa, C. G.; Norn, C.; Brylinski, M.; Skolnick, J.; Keranen, H.; Lenselink, B. E.; Van Westen, G.; Overington, J. P.; De Teraan, H. G.; Isberg, V.; Fidom, K. M.; Lehto, T. M.; Gloriam, D. E.; Ghosh, A.; Sonavane, U.; Joshi, R.; Xia, J.; Hsieh, J. -H.; Zhang, L.; Wang, X. S.; Vogel, H.; Yuan, S.; Feng, X.; Chen, M.; Ambia, J.; Barth, P.; Gageat, C.; Stepniewski, M.; Xhaard, H.; Kelm, S.; Pitt, W. R.; Shi, J.; Larsen, A.; Li, H.; Wagner, J.; Bhattacharya, S.; Vaidehi, N.; Kanou, K.; Cvicek, V.; Kim, S. -K.; Trzaskowski, B.; Goddard, W. A.; Abrol, R.; Selvam, B.; Tikhonova, I. G.; Cuzzolin, A.; Sabbadin, D.; Ciancetta, A.; Moro, S.; Freyd, T.; Gabrielsen, M.; Kristiansen, K.; Sylte, I.; Gaffney, K. J.; Petasis, N. A.; Latek, D.; Bajda, M.; Mlynarczyk, K.; Filipek, S.; Lopez, L.; Kuiper, M.; Beuming, T.; Perez-Aguilar, J. M.; Wang, R. Y. -R.; Park, H.; Greisen, P.; Song, Y.; Dimaio, F.; Baker, D.; Shin, W. -H.; Heo, L.; Lee, G. R.; Seok, C.; Yang, J.; Zhang, Y.; Ponassi, M.; Rosano, C.; Cheremovskiy, G.; Grudinin, S.; Chaudhari, R.; Heim, A. J.; Li, Z.; Lv, Q.; Grigorov, M. G.; Hu, X.; Sun, H.; Shen, M.; Southall, N.; Jadhav, A.; Rodriguez, D.; Ranganathan, A.; Carlsson, J.; Najmanovich, R.; Durdagi, S.; De March, C.; Diharce, J.; Golebiowski, J.; Antonczak, S.; Fiorucci, S.; Nguyen, E.; Meiler, J.; Gutcaits, A.; Marti-Solano, M.; Pastor, M.; Selent, J.; Stevens, R. C.; Abagyan, R.
Alternative quality assessment strategy to compare performances of GPCR-ligand docking protocols: the human adenosine A(2A) receptor as a case study
file con accesso da definire2014 Ciancetta, A; Cuzzolin, A; Moro, S
Aquaporin inhibition by gold(III) compounds: New insights
file con accesso da definire2013 Martins, A P; Ciancetta, A; de Almeida, A; Marrone, Alessandro; Re, N; Soveral, G; Casini, Angela
Breakthrough in GPCR Crystallography and Its Impact on Computer-Aided Drug Design
file con accesso da definire2018 Ciancetta, A.; Jacobson, K. A.
Bridging molecular docking to membrane molecular dynamics to investigate GPCR-ligand recognition: The human A2A adenosine receptor as a key study
2014 Sabbadin, Davide; Ciancetta, Antonella; Moro, Stefano
Conjugates between minor groove binders and Zn(II)-tach complexes: Synthesis, characterization, and interaction with plasmid DNA
file con accesso da definire2017 Sissi, Claudia; Dovigo, Luca; Greco, MARIA LAURA; Ciancetta, Antonella; Moro, Stefano; Trzcinski, JAKUB WALDEMAR; Mancin, Fabrizio; Rossi, Paola; Spalluto, Giampiero; Tecilla, Paolo
Deciphering the Complexity of Ligand-Protein Recognition Pathways Using Supervised Molecular Dynamics (SuMD) Simulations
file con accesso da definire2016 Cuzzolin, Alberto; Sturlese, Mattia; Deganutti, Giuseppe; Salmaso, Veronica; Sabbadin, Davide; Ciancetta, Antonella; Moro, Stefano
Demystifying P2Y1 Receptor Ligand Recognition through Docking and Molecular Dynamics Analyses
file con accesso da definire2017 Ciancetta, A.; O'Connor, R. D.; Paoletta, S.; Jacobson, K. A.
Design and in Vivo Characterization of A 1 Adenosine Receptor Agonists in the Native Ribose and Conformationally Constrained (N)-Methanocarba Series
2019 Tosh, D. K.; Rao, H.; Bitant, A.; Salmaso, V.; Mannes, P.; Lieberman, D. I.; Vaughan, K. L.; Mattison, J. A.; Rothwell, A. C.; Auchampach, J. A.; Ciancetta, A.; Liu, N.; Cui, Z.; Gao, Z. -G.; Reitman, M. L.; Gavrilova, O.; Jacobson, K. A.
DockBench: An Integrated Informatic Platform Bridging the Gap between the Robust Validation of Docking Protocols and Virtual Screening Simulations
file con accesso da definire2015 Cuzzolin, Alberto; Sturlese, Mattia; Malvacio, Ivana; Ciancetta, Antonella; Moro, Stefano
| Titolo | Data di pubblicazione | Autore(i) | File |
|---|---|---|---|
| 2-Arylpyrazolo[4,3-d]pyrimidin-7-amino derivatives as new potent and selective human A3 adenosine receptor antagonists. Molecular modeling studies and pharmacological evaluation | 2013 | Squarcialupi, L.; Colotta, V.; Catarzi, D.; Varano, F.; Filacchioni, G.; Varani, Katia; Corciulo,... Carmen; Vincenzi, Fabrizio; Borea, Pier Andrea; Ghelardini, C.; Di Cesare Mannelli, L.; Ciancetta, A.; Moro, S. | file con accesso da definire |
| 5,7-Disubstituted-[1,2,4]triazolo[1,5-a][1,3,5]triazines as pharmacological tools to explore the antagonist selectivity profiles toward adenosine receptors | 2016 | Federico, Stephanie; Ciancetta, Antonella; Porta, Nicola; Redenti, Sara; Pastorin, Giorgia; Cacci...ari, Barbara; Klotz, Karl Norbert; Moro, Stefano; Spalluto, Giampiero | |
| 7-Amino-2-phenylpyrazolo[4,3-d]pyrimidine derivatives: Structural investigations at the 5-position to target human A(1) and A(2A) adenosine receptors. Molecular modeling and pharmacological studies | 2014 | Squarcialupi, L; Colotta, V; Catarzi, D; Varano, F; Betti, M; Varani, Katia; Vincenzi, Fabrizio; ...Borea, Pier Andrea; Porta, N; Ciancetta, A; Moro, S. | |
| A 2a adenosine receptor: Structures, modeling, and medicinal chemistry | 2018 | Baraldi, S.; Baraldi, P. G.; Oliva, P.; Toti, K. S.; Ciancetta, A.; Jacobson, K. A. | |
| A QM/MM study of the binding of RAPTA ligands to cathepsin B | 2011 | Ciancetta, A; Genheden, S; Ryde, U | file con accesso da definire |
| A3 adenosine receptor activation mechanisms: molecular dynamics analysis of inactive, active, and fully active states | 2019 | Ciancetta, A.; Rubio, P.; Lieberman, D. I.; Jacobson, K. A. | |
| A3 Adenosine Receptors as Modulators of Inflammation: From Medicinal Chemistry to Therapy | 2018 | Jacobson, Ka; Merighi, Stefania; Varani, Katia; Borea, Pier Andrea; Baraldi, Stefania; AGHAZADEH ...TABRIZI, Mojgan; Romagnoli, Romeo; Baraldi, Pier Giovanni; Ciancetta, A; Tosh, Dk; Gao, Zg; Gessi, Stefania | |
| Activation of Carboplatin by Carbonate | 2012 | Ciancetta, A; Coletti, C; Marrone, A; Re, N | file con accesso da definire |
| Activation of carboplatin by chloride ions: a theoretical investigation | 2011 | Ciancetta, Antonella; Coletti, Cecilia; Marrone, Alessandro; Re, Nazzareno | file con accesso da definire |
| Advances in Computational Techniques to Study GPCR-Ligand Recognition | 2015 | Ciancetta, A; Sabbadin, D; Federico, S; Spalluto, G; Moro, S | file con accesso da definire |
| Advances in GPCR modeling evaluated by the GPCR Dock 2013 assessment: Meeting new challenges | 2014 | Kufareva, I.; Katritch, V.; Biggin, P.; Kim, M.; Park, K.; Jung, S. W.; Cho, A. E.; Sands, Z. A.;... Ostopovici-Halip, L.; Bologa, C. G.; Norn, C.; Brylinski, M.; Skolnick, J.; Keranen, H.; Lenselink, B. E.; Van Westen, G.; Overington, J. P.; De Teraan, H. G.; Isberg, V.; Fidom, K. M.; Lehto, T. M.; Gloriam, D. E.; Ghosh, A.; Sonavane, U.; Joshi, R.; Xia, J.; Hsieh, J. -H.; Zhang, L.; Wang, X. S.; Vogel, H.; Yuan, S.; Feng, X.; Chen, M.; Ambia, J.; Barth, P.; Gageat, C.; Stepniewski, M.; Xhaard, H.; Kelm, S.; Pitt, W. R.; Shi, J.; Larsen, A.; Li, H.; Wagner, J.; Bhattacharya, S.; Vaidehi, N.; Kanou, K.; Cvicek, V.; Kim, S. -K.; Trzaskowski, B.; Goddard, W. A.; Abrol, R.; Selvam, B.; Tikhonova, I. G.; Cuzzolin, A.; Sabbadin, D.; Ciancetta, A.; Moro, S.; Freyd, T.; Gabrielsen, M.; Kristiansen, K.; Sylte, I.; Gaffney, K. J.; Petasis, N. A.; Latek, D.; Bajda, M.; Mlynarczyk, K.; Filipek, S.; Lopez, L.; Kuiper, M.; Beuming, T.; Perez-Aguilar, J. M.; Wang, R. Y. -R.; Park, H.; Greisen, P.; Song, Y.; Dimaio, F.; Baker, D.; Shin, W. -H.; Heo, L.; Lee, G. R.; Seok, C.; Yang, J.; Zhang, Y.; Ponassi, M.; Rosano, C.; Cheremovskiy, G.; Grudinin, S.; Chaudhari, R.; Heim, A. J.; Li, Z.; Lv, Q.; Grigorov, M. G.; Hu, X.; Sun, H.; Shen, M.; Southall, N.; Jadhav, A.; Rodriguez, D.; Ranganathan, A.; Carlsson, J.; Najmanovich, R.; Durdagi, S.; De March, C.; Diharce, J.; Golebiowski, J.; Antonczak, S.; Fiorucci, S.; Nguyen, E.; Meiler, J.; Gutcaits, A.; Marti-Solano, M.; Pastor, M.; Selent, J.; Stevens, R. C.; Abagyan, R. | file con accesso da definire |
| Alternative quality assessment strategy to compare performances of GPCR-ligand docking protocols: the human adenosine A(2A) receptor as a case study | 2014 | Ciancetta, A; Cuzzolin, A; Moro, S | file con accesso da definire |
| Aquaporin inhibition by gold(III) compounds: New insights | 2013 | Martins, A P; Ciancetta, A; de Almeida, A; Marrone, Alessandro; Re, N; Soveral, G; Casini, Angela | file con accesso da definire |
| Breakthrough in GPCR Crystallography and Its Impact on Computer-Aided Drug Design | 2018 | Ciancetta, A.; Jacobson, K. A. | file con accesso da definire |
| Bridging molecular docking to membrane molecular dynamics to investigate GPCR-ligand recognition: The human A2A adenosine receptor as a key study | 2014 | Sabbadin, Davide; Ciancetta, Antonella; Moro, Stefano | |
| Conjugates between minor groove binders and Zn(II)-tach complexes: Synthesis, characterization, and interaction with plasmid DNA | 2017 | Sissi, Claudia; Dovigo, Luca; Greco, MARIA LAURA; Ciancetta, Antonella; Moro, Stefano; Trzcinski,... JAKUB WALDEMAR; Mancin, Fabrizio; Rossi, Paola; Spalluto, Giampiero; Tecilla, Paolo | file con accesso da definire |
| Deciphering the Complexity of Ligand-Protein Recognition Pathways Using Supervised Molecular Dynamics (SuMD) Simulations | 2016 | Cuzzolin, Alberto; Sturlese, Mattia; Deganutti, Giuseppe; Salmaso, Veronica; Sabbadin, Davide; Ci...ancetta, Antonella; Moro, Stefano | file con accesso da definire |
| Demystifying P2Y1 Receptor Ligand Recognition through Docking and Molecular Dynamics Analyses | 2017 | Ciancetta, A.; O'Connor, R. D.; Paoletta, S.; Jacobson, K. A. | file con accesso da definire |
| Design and in Vivo Characterization of A 1 Adenosine Receptor Agonists in the Native Ribose and Conformationally Constrained (N)-Methanocarba Series | 2019 | Tosh, D. K.; Rao, H.; Bitant, A.; Salmaso, V.; Mannes, P.; Lieberman, D. I.; Vaughan, K. L.; Matt...ison, J. A.; Rothwell, A. C.; Auchampach, J. A.; Ciancetta, A.; Liu, N.; Cui, Z.; Gao, Z. -G.; Reitman, M. L.; Gavrilova, O.; Jacobson, K. A. | |
| DockBench: An Integrated Informatic Platform Bridging the Gap between the Robust Validation of Docking Protocols and Virtual Screening Simulations | 2015 | Cuzzolin, Alberto; Sturlese, Mattia; Malvacio, Ivana; Ciancetta, Antonella; Moro, Stefano | file con accesso da definire |