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Sandro Cosconati
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2020 – today
- 2024
- [j6]Michele Roggia
, Benito Natale
, Giorgio Amendola
, Salvatore Di Maro
, Sandro Cosconati
:
Streamlining Large Chemical Library Docking with Artificial Intelligence: the PyRMD2Dock Approach. J. Chem. Inf. Model. 64(7): 2143-2149 (2024) - 2023
- [c1]Dario Branco
, Beniamino Di Martino, Sandro Cosconati
, Dieter Kranzlmüller, Salvatore D'Angelo:
Towards a Parallel Graph Approach to Drug Discovery. AINA (3) 2023: 127-135 - 2021
- [j5]Giorgio Amendola
, Roberta Ettari
, Santo Previti
, Carla Di Chio, Anna Messere, Salvatore Di Maro
, Stefan J. Hammerschmidt
, Collin Zimmer
, Robert A. Zimmermann
, Tanja Schirmeister, Maria Zappalà
, Sandro Cosconati
:
Lead Discovery of SARS-CoV-2 Main Protease Inhibitors through Covalent Docking-Based Virtual Screening. J. Chem. Inf. Model. 61(4): 2062-2073 (2021) - [j4]Giorgio Amendola
, Sandro Cosconati
:
PyRMD: A New Fully Automated AI-Powered Ligand-Based Virtual Screening Tool. J. Chem. Inf. Model. 61(8): 3835-3845 (2021) - [j3]Stamatia Zavitsanou
, Alexandros Tsengenes, Michail Papadourakis, Giorgio Amendola
, Alexios Chatzigoulas
, Dimitris Dellis, Sandro Cosconati
, Zoe Cournia
:
FEPrepare: A Web-Based Tool for Automating the Setup of Relative Binding Free Energy Calculations. J. Chem. Inf. Model. 61(9): 4131-4138 (2021)
2010 – 2019
- 2013
- [j2]Magdalena Bacilieri, Antonella Ciancetta
, Silvia Paoletta, Stephanie Federico
, Sandro Cosconati
, Barbara Cacciari, Sabrina Taliani
, Federico Da Settimo
, Ettore Novellino
, Karl Norbert Klotz
, Giampiero Spalluto
, Stefano Moro
:
Revisiting a Receptor-Based Pharmacophore Hypothesis for Human A2A Adenosine Receptor Antagonists. J. Chem. Inf. Model. 53(7): 1620-1637 (2013) - 2012
- [j1]Sandro Cosconati
, Luciana Marinelli
, Francesco Saverio Di Leva
, Valeria La Pietra
, Angela De Simone, Francesca Mancini, Vincenza Andrisano
, Ettore Novellino
, David S. Goodsell, Arthur J. Olson:
Protein Flexibility in Virtual Screening: The BACE-1 Case Study. J. Chem. Inf. Model. 52(10): 2697-2704 (2012)
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last updated on 2024-08-05 21:12 CEST by the dblp team
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