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Journal of Computer-Aided Molecular Design|November 17, 2007
Virtual screening applications: a study of ligand-based methods and different structure representations in four different scenariosDimitar P Hristozov, Tudor I Oprea, Johann Gasteiger
Drug Discovery Today|October 5, 2019
Can BDDCS illuminate targets in drug design?Giovanni Bocci, Leslie Z Benet, Tudor I Oprea
The AAPS Journal|August 6, 2011
BDDCS applied to over 900 drugsLeslie Z Benet, Fabio Broccatelli, Tudor I Oprea
Journal of Combinatorial Chemistry|July 9, 2002
Pharmacokinetically based mapping device for chemical space navigationTudor I Oprea, Ismael Zamora, Anna-Lena Ungell
Methods in Molecular Biology (Clifton, N.J.)|March 9, 2019
How to Prepare a Compound Collection Prior to Virtual ScreeningCristian G Bologa, Oleg Ursu, Tudor I Oprea
Journal of Cheminformatics|January 12, 2021
SmartGraph: a network pharmacology investigation platformGergely Zahoránszky-Kőhalmi, Timothy Sheils, Tudor I Oprea
Journal of Computer-Aided Molecular Design|November 4, 2005
Surrogate data--a secure way to share corporate dataIgor V Tetko, Ruben Abagyan, Tudor I Oprea
Drug Discovery Today|June 18, 2026
How many protein pairs can we chemically target?Maria J Falaguera, Tudor I Oprea, Jordi Mestres
International Journal of Molecular Sciences|January 8, 2023
Toward Quantitative Models in Safety Assessment: A Case Study to Show Impact of Dose-Response Inference on hERG Inhibition ModelsFjodor Melnikov, Lennart T Anger, Catrin Hasselgren
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