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Journal of Medicinal Chemistry|October 21, 2010
Development, validation, and use of quantitative structure-activity relationship models of 5-hydroxytryptamine (2B) receptor ligands to identify novel receptor binders and putative valvulopathic compounds among common drugsRima Hajjo, Christopher M Grulke, Alexander Golbraikh, et al.Journal of Cheminformatics|January 17, 2025
One size does not fit all: revising traditional paradigms for assessing accuracy of QSAR models used for virtual screeningJames Wellnitz, Sankalp Jain, Joshua E Hochuli, et al.Environmental Health Perspectives|May 31, 2018
Conditional Toxicity Value (CTV) Predictor: An In Silico Approach for Generating Quantitative Risk Estimates for ChemicalsJessica A Wignall, Eugene Muratov, Alexander Sedykh, et al.Journal of Chemical Information and Modeling|October 4, 2012
Does rational selection of training and test sets improve the outcome of QSAR modeling?Todd M Martin, Paul Harten, Douglas M Young, et al.Journal of Medicinal Chemistry|November 28, 2006
QSAR modeling of human serum protein binding with several modeling techniques utilizing structure-information representationJoseph R Votano, Marc Parham, L Mark Hall, et al.AIDS Research and Human Retroviruses|February 12, 2014
Short communication: cheminformatics analysis to identify predictors of antiviral drug penetration into the female genital tractCorbin G Thompson, Alexander Sedykh, Melanie R Nicol, et al.JMIR Medical Informatics|July 20, 2021
A Biomedical Knowledge Graph System to Propose Mechanistic Hypotheses for Real-World Environmental Health Observations: Cohort Study and Informatics ApplicationKaramarie Fecho, Chris Bizon, Frederick Miller, et al.Biochemistry|April 21, 2004
A conformational change in heparan sulfate 3-O-sulfotransferase-1 is induced by binding to heparan sulfateSuzanne C Edavettal, Kevin Carrick, Ruchir R Shah, et al.Drug Discovery Today|August 24, 2014
Expanding the scope of drug repurposing in pediatrics: the Children's Pharmacy CollaborativeJulie Blatt, Sherif Farag, Seth J Corey, et al.Toxicology and Applied Pharmacology|May 28, 2013
Identification of putative estrogen receptor-mediated endocrine disrupting chemicals using QSAR- and structure-based virtual screening approachesLiying Zhang, Alexander Sedykh, Ashutosh Tripathi, et al.Pageof 33,890