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Journal of Chemical Information and Modeling|July 16, 2021
PyRMD: A New Fully Automated AI-Powered Ligand-Based Virtual Screening ToolGiorgio Amendola, Sandro Cosconati
Molecular Informatics|August 23, 2016
Best Matching Protein Conformations and Docking Programs for a Virtual Screening Campaign Against SMO ReceptorGiorgio Amendola, Danilo Di Maio, Valeria La Pietra, et al.
Journal of Chemical Information and Modeling|August 8, 2023
Streamlining Large Chemical Library Docking with Artificial Intelligence: the PyRMD2Dock ApproachMichele Roggia, Benito Natale, Giorgio Amendola, et al.
Chemmedchem|April 25, 2020
Development of Novel Benzodiazepine-Based Peptidomimetics as Inhibitors of Rhodesain from Trypanosoma brucei rhodesienseCarla Di Chio, Santo Previti, Giorgio Amendola, et al.
Journal of Chemical Information and Modeling|September 14, 2021
FEPrepare: A Web-Based Tool for Automating the Setup of Relative Binding Free Energy CalculationsStamatia Zavitsanou, Alexandros Tsengenes, Michail Papadourakis, et al.
Journal of Enzyme Inhibition and Medicinal Chemistry|June 11, 2019
Identification of novel indole derivatives acting as inhibitors of the Keap1-Nrf2 interactionBarbara Cosimelli, Giovanni Greco, Sonia Laneri, et al.
Journal of Medicinal Chemistry|November 13, 2019
Optimization Strategy of Novel Peptide-Based Michael Acceptors for the Treatment of Human African TrypanosomiasisRoberta Ettari, Santo Previti, Santina Maiorana, et al.
Chemmedchem|June 23, 2020
Peptidyl Vinyl Ketone Irreversible Inhibitors of Rhodesain: Modifications of the P2 FragmentSantina Maiorana, Roberta Ettari, Santo Previti, et al.
Journal of Medicinal Chemistry|June 11, 2014
The first sphingosine 1-phosphate lyase inhibitors against multiple sclerosis: a successful drug discovery taleSandro Cosconati, Ettore Novellino
European Journal of Medicinal Chemistry|April 6, 2022
Development of novel dipeptide nitriles as inhibitors of rhodesain of Trypanosoma brucei rhodesienseCarla Di Chio, Santo Previti, Giorgio Amendola, et al.
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