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Searching for potential drugs against SARS-CoV-2 through virtual screening on several molecular targets.
Almeida JSFD, Botelho FD, de Souza FR, Dos Santos MC, Goncalves ADS, Rodrigues RLB, Cardozo M, Kitagawa DAS, Vieira LA, Silva RSF, Cavalcante SFA, Bastos LDC, Nogueira MOT, de Santana PIR, Brum JOC, Nepovimova E, Kuca K, LaPlante SR, Galante EBF, Franca TCC. Almeida JSFD, et al. J Biomol Struct Dyn. 2022 Jul;40(11):5229-5242. doi: 10.1080/07391102.2020.1869096. Epub 2021 Jan 8. J Biomol Struct Dyn. 2022. PMID: 33416020 Free PMC article.
Design, synthesis, in silico studies and in vitro evaluation of isatin-pyridine oximes hybrids as novel acetylcholinesterase reactivators.
Kitagawa DAS, Rodrigues RB, Silva TN, Dos Santos WV, da Rocha VCV, de Almeida JSFD, Bernardo LB, Carvalho-Silva T, Ferreira CN, da Silva AAT, Simas ABC, Nepovimova E, Kuča K, França TCC, Cavalcante SFA. Kitagawa DAS, et al. Among authors: de almeida jsfd. J Enzyme Inhib Med Chem. 2021 Dec;36(1):1370-1377. doi: 10.1080/14756366.2021.1916009. J Enzyme Inhib Med Chem. 2021. PMID: 34148470 Free PMC article.
Biodegradation of Organophosphorus Compounds Predicted by Enzymatic Process Using Molecular Modelling and Observed in Soil Samples Through Analytical Techniques and Microbiological Analysis: A Comparison.
Cardozo M, de Almeida JSFD, Cavalcante SFA, Salgado JRS, Gonçalves AS, França TCC, Kuca K, Bizzo HR. Cardozo M, et al. Among authors: de almeida jsfd. Molecules. 2019 Dec 23;25(1):58. doi: 10.3390/molecules25010058. Molecules. 2019. PMID: 31878010 Free PMC article.
In Vitro Evaluation of Neutral Aryloximes as Reactivators for Electrophorus eel Acetylcholinesterase Inhibited by Paraoxon.
Kitagawa DAS, Cavalcante SFA, de Paula RL, Rodrigues RB, Bernardo LB, da Silva MCJ, da Silva TN, Dos Santos WV, Granjeiro JM, de Almeida JSFD, Barcellos MC, de A Correa AB, França TCC, Kuča K, Simas ABC. Kitagawa DAS, et al. Among authors: de almeida jsfd. Biomolecules. 2019 Oct 8;9(10):583. doi: 10.3390/biom9100583. Biomolecules. 2019. PMID: 31597234 Free PMC article.
18 results