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Drug Metabolism and Disposition: the Biological Fate of Chemicals|December 5, 2006
Classification of metabolites with kernel-partial least squares (K-PLS)Mark J Embrechts, Sean EkinsJournal of Chemical Information and Computer Sciences|March 23, 2004
Predicting protein-ligand binding affinities using novel geometrical descriptors and machine-learning methodsWei Deng, Curt Breneman, Mark J EmbrechtsMethods in Molecular Biology (Clifton, N.J.)|July 24, 2012
Predictive cheminformatics in drug discovery: statistical modeling for analysis of micro-array and gene expression dataN Sukumar, Michael P Krein, Mark J EmbrechtsComputers in Biology and Medicine|June 14, 2008
Identification of ischemic heart disease via machine learning analysis on magnetocardiogramsTanawut Tantimongcolwat, Thanakorn Naenna, Chartchalerm Isarankura-Na-Ayudhya, et al.Journal of Computer-Aided Molecular Design|September 19, 2003
New developments in PEST shape/property hybrid descriptorsCurt M Breneman, C Matthew Sundling, N Sukumar, et al.Journal of Chemical Information and Computer Sciences|March 23, 2004
Detection and classification of organophosphate nerve agent simulants using support vector machines with multiarray sensorsOmowunmi Sadik, Walker H Land, Adam K Wanekaya, et al.Iscience|July 31, 2023
Spatial topology of organelle is a new breast cancer cell classifierLing Wang, Joshua Goldwag, Megan Bouyea, et al.Pageof 1