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BigSMILES: A Structurally-Based Line Notation for Describing Macromolecules.
Lin TS, Coley CW, Mochigase H, Beech HK, Wang W, Wang Z, Woods E, Craig SL, Johnson JA, Kalow JA, Jensen KF, Olsen BD. Lin TS, et al. Among authors: jensen kf. ACS Cent Sci. 2019 Sep 25;5(9):1523-1531. doi: 10.1021/acscentsci.9b00476. Epub 2019 Sep 12. ACS Cent Sci. 2019. PMID: 31572779 Free PMC article.
Prediction of Organic Reaction Outcomes Using Machine Learning.
Coley CW, Barzilay R, Jaakkola TS, Green WH, Jensen KF. Coley CW, et al. Among authors: jensen kf. ACS Cent Sci. 2017 May 24;3(5):434-443. doi: 10.1021/acscentsci.7b00064. Epub 2017 Apr 18. ACS Cent Sci. 2017. PMID: 28573205 Free PMC article.
Computer-Assisted Retrosynthesis Based on Molecular Similarity.
Coley CW, Rogers L, Green WH, Jensen KF. Coley CW, et al. Among authors: jensen kf. ACS Cent Sci. 2017 Dec 27;3(12):1237-1245. doi: 10.1021/acscentsci.7b00355. Epub 2017 Nov 16. ACS Cent Sci. 2017. PMID: 29296663 Free PMC article.
SCScore: Synthetic Complexity Learned from a Reaction Corpus.
Coley CW, Rogers L, Green WH, Jensen KF. Coley CW, et al. Among authors: jensen kf. J Chem Inf Model. 2018 Feb 26;58(2):252-261. doi: 10.1021/acs.jcim.7b00622. Epub 2018 Jan 26. J Chem Inf Model. 2018. PMID: 29309147
Ligand-Mediated Nanocrystal Growth.
Lazzari S, Theiler PM, Shen Y, Coley CW, Stemmer A, Jensen KF. Lazzari S, et al. Among authors: jensen kf. Langmuir. 2018 Mar 13;34(10):3307-3315. doi: 10.1021/acs.langmuir.8b00076. Epub 2018 Feb 28. Langmuir. 2018. PMID: 29429346
283 results