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A Brief Introduction to Chemical Reaction Optimization.
Taylor CJ, Pomberger A, Felton KC, Grainger R, Barecka M, Chamberlain TW, Bourne RA, Johnson CN, Lapkin AA. Taylor CJ, et al. Among authors: felton kc. Chem Rev. 2023 Mar 22;123(6):3089-3126. doi: 10.1021/acs.chemrev.2c00798. Epub 2023 Feb 23. Chem Rev. 2023. PMID: 36820880 Free PMC article. Review.
Accelerated Chemical Reaction Optimization Using Multi-Task Learning.
Taylor CJ, Felton KC, Wigh D, Jeraal MI, Grainger R, Chessari G, Johnson CN, Lapkin AA. Taylor CJ, et al. Among authors: felton kc. ACS Cent Sci. 2023 Apr 13;9(5):957-968. doi: 10.1021/acscentsci.3c00050. eCollection 2023 May 24. ACS Cent Sci. 2023. PMID: 37252348 Free PMC article.
ORDerly: Data Sets and Benchmarks for Chemical Reaction Data.
Wigh DS, Arrowsmith J, Pomberger A, Felton KC, Lapkin AA. Wigh DS, et al. Among authors: felton kc. J Chem Inf Model. 2024 May 13;64(9):3790-3798. doi: 10.1021/acs.jcim.4c00292. Epub 2024 Apr 22. J Chem Inf Model. 2024. PMID: 38648077 Free PMC article.