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Identification of potential human beta-secretase 1 inhibitors by hierarchical virtual screening and molecular dynamics.
J Biomol Struct Dyn. 2023 Jul;41(10):4560-4574. doi: 10.1080/07391102.2022.2069155. Epub 2022 May 1.
J Biomol Struct Dyn. 2023.
PMID: 35491692
Identification of potential modulator of Anopheles gambiae odorant binding protein 1 by hierarchical virtual screening and molecular dynamics.
do Bomfim MR, Araújo JSC, Macêdo WJDC, Santos CBRD, Leite FHA.
do Bomfim MR, et al.
J Biomol Struct Dyn. 2021 Oct;39(16):6031-6043. doi: 10.1080/07391102.2020.1796807. Epub 2020 Jul 22.
J Biomol Struct Dyn. 2021.
PMID: 32696721
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JM-20, a Benzodiazepine-Dihydropyridine Hybrid Molecule, Inhibits the Formation of Alpha-Synuclein-Aggregated Species.
Santos CC, Cardim-Pires TR, Shvachiy L, Fonseca-Fonseca LA, Muñoz P, Almeida ÁMAN, Costa ACS, Teles-Souza J, Ochoa-Rodríguez E, de Fátima Dias Costa M, Palhano FL, Segura-Aguilar J, Barbosa DB, do Bomfim MR, Dos Santos Junior MC, Leite FHA, da Rocha Pita SS, Costa SL, Núñez-Figueredo Y, Outeiro TF, Foguel D, Silva VDA.
Santos CC, et al. Among authors: do bomfim mr.
Neurotox Res. 2022 Dec;40(6):2135-2147. doi: 10.1007/s12640-022-00559-7. Epub 2022 Aug 23.
Neurotox Res. 2022.
PMID: 35997936
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Development of Potential Multi-Target Inhibitors for Human Cholinesterases and Beta-Secretase 1: A Computational Approach.
Barbosa DB, do Bomfim MR, de Oliveira TA, da Silva AM, Taranto AG, Cruz JN, de Carvalho PB, Campos JM, Santos CBR, Leite FHA.
Barbosa DB, et al. Among authors: do bomfim mr.
Pharmaceuticals (Basel). 2023 Nov 28;16(12):1657. doi: 10.3390/ph16121657.
Pharmaceuticals (Basel). 2023.
PMID: 38139784
Free PMC article.
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Identification of a Novel Dual Inhibitor of Acetylcholinesterase and Butyrylcholinesterase: In Vitro and In Silico Studies.
de Almeida RBM, Barbosa DB, do Bomfim MR, Amparo JAO, Andrade BS, Costa SL, Campos JM, Cruz JN, Santos CBR, Leite FHA, Botura MB.
de Almeida RBM, et al. Among authors: do bomfim mr.
Pharmaceuticals (Basel). 2023 Jan 9;16(1):95. doi: 10.3390/ph16010095.
Pharmaceuticals (Basel). 2023.
PMID: 36678592
Free PMC article.
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