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Pharmaceutical Research|August 31, 2013
Computational models for neglected diseases: gaps and opportunitiesElizabeth L Ponder, Joel S Freundlich, Malabika Sarker, et al.Current Drug Metabolism|June 10, 2008
Molecular characterization of CYP2B6 substratesSean Ekins, Manisha Iyer, Matthew D Krasowski, et al.F1000Research|February 17, 2015
Collaboration for rare disease drug discovery researchNadia K Litterman, Michele Rhee, David C Swinney, et al.Journal of Chemical Information and Modeling|August 25, 2007
2D depiction of protein-ligand complexesAlex M Clark, Paul LabuteJournal of Medicinal Chemistry|December 20, 2008
Detection and assignment of common scaffolds in project databases of lead moleculesAlex M Clark, Paul LabuteMolecular Pharmacology|July 16, 2016
Lack of Influence of Substrate on Ligand Interaction with the Human Multidrug and Toxin Extruder, MATE1Lucy J Martínez-Guerrero, Mark Morales, Sean Ekins, et al.Pharmaceutical Research|August 28, 2015
Thermodynamic Proxies to Compensate for Biases in Drug Discovery MethodsSean Ekins, Nadia K Litterman, Christopher A Lipinski, et al.Methods in Molecular Biology (Clifton, N.J.)|April 27, 2010
Targeting drug transporters - combining in silico and in vitro approaches to predict in vivoPraveen M Bahadduri, James E Polli, Peter W Swaan, et al.Journal of Computer-Aided Molecular Design|December 20, 2002
Towards a new age of virtual ADME/TOX and multidimensional drug discoverySean Ekins, Bruno Boulanger, Peter W Swaan, et al.Molecular Diversity|January 29, 2003
Towards a new age of virtual ADME/TOX and multidimensional drug discoverySean Ekins, Bruno Boulanger, Peter W Swaan, et al.Pageof 37