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Computational Biology and Chemistry|October 15, 2013
A systems chemical biology study of malate synthase and isocitrate lyase inhibition in Mycobacterium tuberculosis during active and NRP growthElebeoba E May, Andrei Leitão, Alexander Tropsha, et al.Current Topics in Medicinal Chemistry|May 9, 2014
Integrative approaches for predicting in vivo effects of chemicals from their structural descriptors and the results of short-term biological assaysYen Sia Low, Alexander Yeugenyevich Sedykh, Ivan Rusyn, et al.Journal of Chemical Information and Modeling|April 7, 2016
Docking and Scoring with Target-Specific Pose Classifier Succeeds in Native-Like Pose Identification But Not Binding Affinity Prediction in the CSAR 2014 Benchmark ExerciseRegina Politi, Marino Convertino, Konstantin Popov, et al.Drug Safety|June 8, 2018
Predicting Adverse Drug Effects from Literature- and Database-Mined AssertionsMary K La, Alexander Sedykh, Denis Fourches, et al.American Journal of Pharmaceutical Education|May 13, 2017
Computer-Assisted Decision Support for Student Admissions Based on Their Predicted Academic PerformanceEugene Muratov, Margaret Lewis, Denis Fourches, et al.Journal of Medicinal Chemistry|June 23, 2009
Discovery of geranylgeranyltransferase-I inhibitors with novel scaffolds by the means of quantitative structure-activity relationship modeling, virtual screening, and experimental validationYuri K Peterson, Xiang S Wang, Patrick J Casey, et al.Toxicological Sciences : an Official Journal of the Society of Toxicology|March 6, 2012
Predictive modeling of chemical hazard by integrating numerical descriptors of chemical structures and short-term toxicity assay dataIvan Rusyn, Alexander Sedykh, Yen Low, et al.Chemical Research in Toxicology|March 3, 2010
Modeling liver-related adverse effects of drugs using knearest neighbor quantitative structure-activity relationship methodAmie D Rodgers, Hao Zhu, Denis Fourches, et al.NPJ Vaccines|September 1, 2023
Identifying a causal link between prolactin signaling pathways and COVID-19 vaccine-induced menstrual changesRima Hajjo, Ensaf Momani, Dima A Sabbah, et al.Journal of Chemical Information and Modeling|March 5, 2021
ZINC Express: A Virtual Assistant for Purchasing Compounds Annotated in the ZINC DatabaseTesia M Bobrowski, Daniel R Korn, Eugene N Muratov, et al.Pageof 26