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Behavior of uncharged oximes compared to HI6 and 2-PAM in the human AChE-tabun conjugate: a molecular modeling approach.
J Biomol Struct Dyn. 2018 May;36(6):1430-1438. doi: 10.1080/07391102.2017.1324322. Epub 2017 May 18.
J Biomol Struct Dyn. 2018.
PMID: 28446076
Design of inhibitors of thymidylate kinase from Variola virus as new selective drugs against smallpox: part II.
Rodrigues Garcia D, Rodrigues de Souza F, Paula Guimarães A, Castro Ramalho T, Palermo de Aguiar A, Celmar Costa França T.
Rodrigues Garcia D, et al.
J Biomol Struct Dyn. 2019 Oct;37(17):4569-4579. doi: 10.1080/07391102.2018.1554510. Epub 2019 Jan 2.
J Biomol Struct Dyn. 2019.
PMID: 30488769
Free PMC article.
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Molecular Modeling Study of Uncharged Oximes Compared to HI-6 and 2-PAM Inside Human AChE Sarin and VX Conjugates.
Souza FR, Rodrigues Garcia D, Cuya T, Pimentel AS, Gonçalves ADS, Alencastro RB, França TCC.
Souza FR, et al. Among authors: rodrigues garcia d.
ACS Omega. 2020 Feb 26;5(9):4490-4500. doi: 10.1021/acsomega.9b03737. eCollection 2020 Mar 10.
ACS Omega. 2020.
PMID: 32175496
Free PMC article.
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