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Journal of Chemical Information and Modeling|May 23, 2006
Combinatorial QSAR modeling of P-glycoprotein substratesPatricia de Cerqueira Lima, Alexander Golbraikh, Scott Oloff, et al.
Journal of Chemical Information and Modeling|January 14, 2014
Application of quantitative structure-activity relationship models of 5-HT1A receptor binding to virtual screening identifies novel and potent 5-HT1A ligandsMan Luo, Xiang Simon Wang, Bryan L Roth, et al.
Computer Applications in the Biosciences : CABIOS|December 1, 1995
Rapid protein structure classification using one-dimensional structure profiles on the bioSCAN parallel computerD L Hoffman, S Laiter, R K Singh, et al.
Journal of Medicinal Chemistry|March 29, 1996
Antitumor agents. 163. Three-dimensional quantitative structure-activity relationship study of 4'-O-demethylepipodophyllotoxin analogs using the modified CoMFA/q2-GRS approachS J Cho, A Tropsha, M Suffness, et al.
Journal of Medicinal Chemistry|April 16, 2004
Application of predictive QSAR models to database mining: identification and experimental validation of novel anticonvulsant compoundsMin Shen, Cécile Béguin, Alexander Golbraikh, et al.
Protein Science : a Publication of the Protein Society|August 1, 1995
Pseudotorsional OCCO backbone angle as a single descriptor of protein secondary structureS Laiter, D L Hoffman, R K Singh, et al.
American Journal of Pharmaceutical Education|July 24, 2021
Moving Towards FAIR Data Practices in Pharmacy EducationJacqueline E McLaughlin, Alexander Tropsha, Joseph A Nicolazzo, et al.
Journal of Controlled Release : Official Journal of the Controlled Release Society|November 19, 2022
Efficient design of peptide-binding polymers using active learning approachesAssima Rakhimbekova, Anton Lopukhov, Natalia Klyachko, et al.
Biomolecules|June 21, 2020
Computer-Aided Discovery of New Solubility-Enhancing Drug Delivery SystemMikołaj Mizera, Eugene N Muratov, Vinicius M Alves, et al.
Bioorganic & Medicinal Chemistry|June 20, 2006
Novel ligands for the human histamine H1 receptor: synthesis, pharmacology, and comparative molecular field analysis studies of 2-dimethylamino-5-(6)-phenyl-1,2,3,4-tetrahydronaphthalenesOla M Ghoneim, Jacqueline A Legere, Alexander Golbraikh, et al.
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