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Biomedicines|February 25, 2022
Ribose and Non-Ribose A2A Adenosine Receptor Agonists: Do They Share the Same Receptor Recognition Mechanism?Giovanni Bolcato, Matteo Pavan, Davide Bassani, et al.
Pharmaceuticals (Basel, Switzerland)|February 26, 2022
Re-Exploring the Ability of Common Docking Programs to Correctly Reproduce the Binding Modes of Non-Covalent Inhibitors of SARS-CoV-2 Protease M<sup>pro</sup>Davide Bassani, Matteo Pavan, Giovanni Bolcato, et al.
Frontiers in Molecular Biosciences|July 25, 2022
Implementing a Scoring Function Based on Interaction Fingerprint for Autogrow4: Protein Kinase CK1δ as a Case StudyMatteo Pavan, Silvia Menin, Davide Bassani, et al.
Journal of Chemical Information and Modeling|October 31, 2022
Qualitative Estimation of Protein-Ligand Complex Stability through Thermal Titration Molecular Dynamics SimulationsMatteo Pavan, Silvia Menin, Davide Bassani, et al.
Frontiers in Endocrinology|March 24, 2022
Omicron Variant of SARS-CoV-2 Virus: <i>In Silico</i> Evaluation of the Possible Impact on People Affected by Diabetes MellitusDavide Bassani, Eugenio Ragazzi, Annunziata Lapolla, et al.
Expert Opinion on Drug Discovery|May 10, 2024
Another string to your bow: machine learning prediction of the pharmacokinetic properties of small moleculesDavide Bassani, Neil John Parrott, Nenad Manevski, et al.
Journal of Enzyme Inhibition and Medicinal Chemistry|July 22, 2021
Supervised Molecular Dynamics (SuMD) Insights into the mechanism of action of SARS-CoV-2 main protease inhibitor PF-07321332Matteo Pavan, Giovanni Bolcato, Davide Bassani, et al.
Current Medicinal Chemistry|February 9, 2022
Computational Strategies to Identify New Drug Candidates against NeuroinflammationMatteo Pavan, Davide Bassani, Giovanni Bolcato, et al.
Chemmedchem|April 2, 2021
Inspecting the Mechanism of Fragment Hits Binding on SARS-CoV-2 M<sup>pro</sup> by Using Supervised Molecular Dynamics (SuMD) SimulationsMaicol Bissaro, Giovanni Bolcato, Matteo Pavan, et al.
Scientific Reports|November 25, 2021
In silico evaluation of the interaction between ACE2 and SARS-CoV-2 Spike protein in a hyperglycemic environmentGiovanni Sartore, Davide Bassani, Eugenio Ragazzi, et al.
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