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Context Aware Data-Driven Retrosynthetic Analysis.
Nicolaou CA, Watson IA, LeMasters M, Masquelin T, Wang J. Nicolaou CA, et al. Among authors: wang j. J Chem Inf Model. 2020 Jun 22;60(6):2728-2738. doi: 10.1021/acs.jcim.9b01141. Epub 2020 Apr 24. J Chem Inf Model. 2020. PMID: 32282195
Idea2Data: Toward a New Paradigm for Drug Discovery.
Nicolaou CA, Humblet C, Hu H, Martin EM, Dorsey FC, Castle TM, Burton KI, Hu H, Hendle J, Hickey MJ, Duerksen J, Wang J, Erickson JA. Nicolaou CA, et al. Among authors: wang j. ACS Med Chem Lett. 2019 Feb 4;10(3):278-286. doi: 10.1021/acsmedchemlett.8b00488. eCollection 2019 Mar 14. ACS Med Chem Lett. 2019. PMID: 30891127 Free PMC article.
A retrosynthetic analysis algorithm implementation.
Watson IA, Wang J, Nicolaou CA. Watson IA, et al. Among authors: wang j. J Cheminform. 2019 Jan 3;11(1):1. doi: 10.1186/s13321-018-0323-6. J Cheminform. 2019. PMID: 30604073 Free PMC article.
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