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2019 2
2020 4
2021 2
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Page 1
Chemical Composition, Antimicrobial Properties of Siparuna guianensis Essential Oil and a Molecular Docking and Dynamics Molecular Study of its Major Chemical Constituent.
Santana de Oliveira M, da Cruz JN, Almeida da Costa W, Silva SG, Brito MDP, de Menezes SAF, de Jesus Chaves Neto AM, de Aguiar Andrade EH, de Carvalho Junior RN. Santana de Oliveira M, et al. Among authors: da cruz jn. Molecules. 2020 Aug 25;25(17):3852. doi: 10.3390/molecules25173852. Molecules. 2020. PMID: 32854178 Free PMC article.
Potential inhibitors of the enzyme acetylcholinesterase and juvenile hormone with insecticidal activity: study of the binding mode via docking and molecular dynamics simulations.
Ramos RS, Macêdo WJC, Costa JS, da Silva CHTP, Rosa JMC, da Cruz JN, de Oliveira MS, de Aguiar Andrade EH, E Silva RBL, Souto RNP, Santos CBR. Ramos RS, et al. Among authors: da cruz jn. J Biomol Struct Dyn. 2020 Oct;38(16):4687-4709. doi: 10.1080/07391102.2019.1688192. Epub 2019 Nov 11. J Biomol Struct Dyn. 2020. PMID: 31674282
Pharmacophore-based virtual screening and molecular docking to identify promising dual inhibitors of human acetylcholinesterase and butyrylcholinesterase.
Mascarenhas AMS, de Almeida RBM, de Araujo Neto MF, Mendes GO, da Cruz JN, Dos Santos CBR, Botura MB, Leite FHA. Mascarenhas AMS, et al. Among authors: da cruz jn. J Biomol Struct Dyn. 2021 Oct;39(16):6021-6030. doi: 10.1080/07391102.2020.1796791. Epub 2020 Jul 24. J Biomol Struct Dyn. 2021. PMID: 32705955
Chemical profile of Lippia thymoides, evaluation of the acetylcholinesterase inhibitory activity of its essential oil, and molecular docking and molecular dynamics simulations.
Silva SG, da Costa RA, de Oliveira MS, da Cruz JN, Figueiredo PLB, Brasil DDSB, Nascimento LD, Chaves Neto AMJ, de Carvalho Junior RN, Andrade EHA. Silva SG, et al. Among authors: da cruz jn. PLoS One. 2019 Mar 8;14(3):e0213393. doi: 10.1371/journal.pone.0213393. eCollection 2019. PLoS One. 2019. PMID: 30849129 Free PMC article.