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Machine Learning Guided Atom Mapping of Metabolic Reactions.
Litsa EE, Peña MI, Moll M, Giannakopoulos G, Bennett GN, Kavraki LE. Litsa EE, et al. J Chem Inf Model. 2019 Mar 25;59(3):1121-1135. doi: 10.1021/acs.jcim.8b00434. Epub 2018 Dec 14. J Chem Inf Model. 2019. PMID: 30500191