Joyce S. F. D. de Almeida - Search Results

Year	Number of Results
2016	1
2018	4
2019	6
2020	1
2021	2
2022	1
2024	0

1

Identification of novel potential ricin inhibitors by virtual screening, molecular docking, molecular dynamics and MM-PBSA calculations: a drug repurposing approach.

Botelho FD, Santos MC, Gonçalves AS, França TCC, LaPlante SR, de Almeida JSFD. Botelho FD, et al. Among authors: de almeida jsfd. J Biomol Struct Dyn. 2022 Aug;40(12):5309-5319. doi: 10.1080/07391102.2020.1870154. Epub 2021 Jan 7. J Biomol Struct Dyn. 2022. PMID: 33410376

2

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.

3

Synthesis of New Quinoline-Piperonal Hybrids as Potential Drugs against Alzheimer's Disease.

de Oliveira C Brum J, Neto DCF, de Almeida JSFD, Lima JA, Kuca K, França TCC, Figueroa-Villar JD. de Oliveira C Brum J, et al. Int J Mol Sci. 2019 Aug 14;20(16):3944. doi: 10.3390/ijms20163944. Int J Mol Sci. 2019. PMID: 31416113 Free PMC article.

4

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.

5

Ligand-Based Virtual Screening, Molecular Docking, Molecular Dynamics, and MM-PBSA Calculations towards the Identification of Potential Novel Ricin Inhibitors.

Botelho FD, Dos Santos MC, Gonçalves ADS, Kuca K, Valis M, LaPlante SR, França TCC, de Almeida JSFD. Botelho FD, et al. Among authors: de almeida jsfd. Toxins (Basel). 2020 Nov 26;12(12):746. doi: 10.3390/toxins12120746. Toxins (Basel). 2020. PMID: 33256167 Free PMC article.

6

Molecular Modeling and In Vitro Studies of a Neutral Oxime as a Potential Reactivator for Acetylcholinesterase Inhibited by Paraoxon.

de Paula RL, de Almeida JSFD, Cavalcante SFA, Gonçalves AS, Simas ABC, Franca TCC, Valis M, Kuca K, Nepovimova E, Granjeiro JM. de Paula RL, et al. Among authors: de almeida jsfd. Molecules. 2018 Nov 12;23(11):2954. doi: 10.3390/molecules23112954. Molecules. 2018. PMID: 30424582 Free PMC article.

7

Molecular Modeling Studies on the Interactions of Aflatoxin B1 and Its Metabolites with Human Acetylcholinesterase. Part II: Interactions with the Catalytic Anionic Site (CAS).

de Almeida JSFD, Dolezal R, Krejcar O, Kuca K, Musilek K, Jun D, França TCC. de Almeida JSFD, et al. Toxins (Basel). 2018 Sep 25;10(10):389. doi: 10.3390/toxins10100389. Toxins (Basel). 2018. PMID: 30257474 Free PMC article.

8

Synthesis and in vitro evaluation of neutral aryloximes as reactivators of Electrophorus eel acetylcholinesterase inhibited by NEMP, a VX surrogate.

Cavalcante SFA, Kitagawa DAS, Rodrigues RB, Bernardo LB, da Silva TN, Dos Santos WV, Correa ABA, de Almeida JSFD, França TCC, Kuča K, Simas ABC. Cavalcante SFA, et al. Among authors: de almeida jsfd. Chem Biol Interact. 2019 Aug 25;309:108682. doi: 10.1016/j.cbi.2019.05.048. Epub 2019 Jun 1. Chem Biol Interact. 2019. PMID: 31163137

9

Docking and molecular dynamics studies of peripheral site ligand-oximes as reactivators of sarin-inhibited human acetylcholinesterase.

de Almeida JS, Cuya Guizado TR, Guimarães AP, Ramalho TC, Gonçalves AS, de Koning MC, França TC. de Almeida JS, et al. J Biomol Struct Dyn. 2016 Dec;34(12):2632-2642. doi: 10.1080/07391102.2015.1124807. Epub 2016 May 9. J Biomol Struct Dyn. 2016. PMID: 26612005

10

Surface screening, molecular modeling and in vitro studies on the interactions of aflatoxin M1 and human enzymes acetyl- and butyrylcholinesterase.

de Almeida JSFD, Cavalcante SFA, Dolezal R, Kuca K, Musilek K, Jun D, França TCC. de Almeida JSFD, et al. Chem Biol Interact. 2019 Aug 1;308:113-119. doi: 10.1016/j.cbi.2019.05.022. Epub 2019 May 14. Chem Biol Interact. 2019. PMID: 31100275

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