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Cold Spring Harbor Perspectives in Medicine|November 3, 2025
Tuberculosis Drug Discovery in the Age of Artificial IntelligenceSean Ekins, Thomas R Lane, Jason T WongJournal of Clinical Nursing|June 7, 2003
"It's like an explosion in your life...": lay perspectives on stress and myocardial infarctionAlex M ClarkJournal of Chemical Information and Modeling|November 25, 2011
Accurate specification of molecular structures: the case for zero-order bonds and explicit hydrogen countingAlex M ClarkJournal of Chemical Information and Modeling|December 30, 2009
2D depiction of fragment hierarchiesAlex M ClarkMolecular Informatics|August 3, 2016
Rendering Molecular Sketches for Publication Quality OutputAlex M ClarkJournal of Cheminformatics|October 7, 2010
Basic primitives for molecular diagram sketchingAlex M ClarkHeliyon|November 6, 2019
Extracellular binding of indinavir to matrix metalloproteinase-2 and the alpha-7-nicotinic acetylcholine receptor: implications for use in cancer treatmentAnna Lee, Erin Saito, Sean Ekins, et al.Journal of Chemical Information and Modeling|January 25, 2023
Preventing AI From Creating Biochemical ThreatsFabio Urbina, Filippa Lentzos, Cédric Invernizzi, et al.Drug Metabolism and Disposition: the Biological Fate of Chemicals|September 17, 2010
A predictive ligand-based Bayesian model for human drug-induced liver injurySean Ekins, Antony J Williams, Jinghai J XuDrug Discovery Today|May 5, 2010
Evolving molecules using multi-objective optimization: applying to ADME/ToxSean Ekins, J Dana Honeycutt, James T MetzPageof 37