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Andrographolide: A Diterpenoid from Cymbopogon schoenanthus Identified as a New Hit Compound against Trypanosoma cruzi Using Machine Learning and Experimental Approaches.
Barbosa H, Espinoza GZ, Amaral M, de Castro Levatti EV, Abiuzi MB, Veríssimo GC, Fernandes PO, Maltarollo VG, Tempone AG, Honorio KM, Lago JHG. Barbosa H, et al. Among authors: espinoza gz. J Chem Inf Model. 2024 Apr 8;64(7):2565-2576. doi: 10.1021/acs.jcim.3c01410. Epub 2023 Dec 26. J Chem Inf Model. 2024. PMID: 38148604
Advances with support vector machines for novel drug discovery.
Maltarollo VG, Kronenberger T, Espinoza GZ, Oliveira PR, Honorio KM. Maltarollo VG, et al. Among authors: espinoza gz. Expert Opin Drug Discov. 2019 Jan;14(1):23-33. doi: 10.1080/17460441.2019.1549033. Epub 2018 Nov 29. Expert Opin Drug Discov. 2019. PMID: 30488731 Review.