Arlan da S. Gonçalves - Search Results

Year	Number of Results
2016	1
2017	2
2018	1
2019	1
2020	4
2021	4
2022	5
2023	1
2024	0

1

Insights into β-amyloid transition prevention by cucurbit[7]uril from molecular modeling.

de Oliveira OV, Gonçalves ADS, Almeida NEC. de Oliveira OV, et al. J Biomol Struct Dyn. 2022;40(20):9602-9612. doi: 10.1080/07391102.2021.1932600. Epub 2021 May 27. J Biomol Struct Dyn. 2022. PMID: 34042019

2

Flavanones: A potential natural inhibitor of the ATP binding site of PknG of Mycobacterium tuberculosis.

Swain SP, Gupta S, Das N, Franca TCC, Goncalves ADS, Ramalho TC, Subrahmanya S, Narsaria U, Deb D, Mishra N. Swain SP, et al. J Biomol Struct Dyn. 2022;40(22):11885-11899. doi: 10.1080/07391102.2021.1965913. Epub 2021 Aug 19. J Biomol Struct Dyn. 2022. PMID: 34409917

3

Determining the Predominant Conformations of Mortiamides A-D in Solution Using NMR Data and Molecular Modeling Tools.

Franca TCC, Goncalves ADS, Bérubé C, Voyer N, Aubry N, LaPlante SR. Franca TCC, et al. ACS Omega. 2023 Jul 11;8(29):25832-25838. doi: 10.1021/acsomega.3c01206. eCollection 2023 Jul 25. ACS Omega. 2023. PMID: 37521620 Free PMC article.

4

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.

5

A Computational Approach Applied to the Study of Potential Allosteric Inhibitors Protease NS2B/NS3 from Dengue Virus.

Costa RAD, Rocha JAPD, Pinheiro AS, Costa ADSSD, Rocha ECMD, Silva RC, Gonçalves ADS, Santos CBR, Brasil DDSB. Costa RAD, et al. Among authors: goncalves ads. Molecules. 2022 Jun 27;27(13):4118. doi: 10.3390/molecules27134118. Molecules. 2022. PMID: 35807364 Free PMC article.

6

Interaction effects between macromolecules and photosensitizer on the ability of AlPc and InPc-loaded PHB magnetic nanoparticles in photooxidatizing simple biomolecules.

Figueiredo BS, Ferreira JNS, Vasconcelos VVV, Ribeiro JN, Guimarães MCC, Gonçalves ADS, da Silva AR. Figueiredo BS, et al. Int J Biol Macromol. 2022 Jul 1;212:579-593. doi: 10.1016/j.ijbiomac.2022.05.135. Epub 2022 May 23. Int J Biol Macromol. 2022. PMID: 35618092 Free article.

7

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: goncalves ads. Toxins (Basel). 2020 Nov 26;12(12):746. doi: 10.3390/toxins12120746. Toxins (Basel). 2020. PMID: 33256167 Free PMC article.

8

The role of the oximes HI-6 and HS-6 inside human acetylcholinesterase inhibited with nerve agents: a computational study.

Cuya T, Gonçalves ADS, da Silva JAV, Ramalho TC, Kuca K, C C França T. Cuya T, et al. J Biomol Struct Dyn. 2018 Oct;36(13):3444-3452. doi: 10.1080/07391102.2017.1389307. Epub 2017 Oct 27. J Biomol Struct Dyn. 2018. PMID: 29019446

9

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. 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.

10

Complete chemical shift assignment and molecular modeling studies of two chromene derivatives as potential leads for new anticancer drugs.

Rubim de Santana PI, Ferreira Neto DC, Goncalves ADS, Almeida JSFD, França TCC, Figueroa-Villar JD. Rubim de Santana PI, et al. J Biomol Struct Dyn. 2021 Sep;39(15):5498-5508. doi: 10.1080/07391102.2020.1790419. Epub 2020 Jul 13. J Biomol Struct Dyn. 2021. PMID: 32657645

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