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ROBOKOP KG and KGB: Integrated Knowledge Graphs from Federated Sources.
Bizon C, Cox S, Balhoff J, Kebede Y, Wang P, Morton K, Fecho K, Tropsha A. Bizon C, et al. Among authors: tropsha a. J Chem Inf Model. 2019 Dec 23;59(12):4968-4973. doi: 10.1021/acs.jcim.9b00683. Epub 2019 Dec 12. J Chem Inf Model. 2019. PMID: 31769676
Discovery of novel antimalarial compounds enabled by QSAR-based virtual screening.
Zhang L, Fourches D, Sedykh A, Zhu H, Golbraikh A, Ekins S, Clark J, Connelly MC, Sigal M, Hodges D, Guiguemde A, Guy RK, Tropsha A. Zhang L, et al. Among authors: tropsha a. J Chem Inf Model. 2013 Feb 25;53(2):475-92. doi: 10.1021/ci300421n. Epub 2013 Jan 23. J Chem Inf Model. 2013. PMID: 23252936 Free PMC article.
Data set modelability by QSAR.
Golbraikh A, Muratov E, Fourches D, Tropsha A. Golbraikh A, et al. Among authors: tropsha a. J Chem Inf Model. 2014 Jan 27;54(1):1-4. doi: 10.1021/ci400572x. Epub 2014 Jan 8. J Chem Inf Model. 2014. PMID: 24251851 Free PMC article.
273 results