Federico LB - Search Results

1

Identification of New Inhibitors with Potential Antitumor Activity from Polypeptide Structures via Hierarchical Virtual Screening.

Ferreira EFB, Silva LB, Costa GV, Costa JS, Fujishima MAT, Leão RP, Ferreira ALS, Federico LB, Silva CHTP, Rosa JMC, Macêdo WJC, Santos CBR. Ferreira EFB, et al. Among authors: federico lb. Molecules. 2019 Aug 14;24(16):2943. doi: 10.3390/molecules24162943. Molecules. 2019. PMID: 31416180 Free PMC article.

2

Molecular modeling and statistical analysis in the design of derivatives of human dipeptidyl peptidase IV.

Pereira ALE, Dos Santos GB, Franco MSF, Federico LB, da Silva CHTP, Santos CBR. Pereira ALE, et al. Among authors: federico lb. J Biomol Struct Dyn. 2018 Feb;36(2):318-334. doi: 10.1080/07391102.2016.1277163. Epub 2017 Jan 24. J Biomol Struct Dyn. 2018. PMID: 28027711

3

Pharmacophore and structure-based drug design, molecular dynamics and admet/tox studies to design novel potential pad4 inhibitors.

Barcellos MP, Santos CBR, Federico LB, Almeida PF, da Silva CHTP, Taft CA. Barcellos MP, et al. Among authors: federico lb. J Biomol Struct Dyn. 2019 Mar;37(4):966-981. doi: 10.1080/07391102.2018.1444511. Epub 2018 Mar 12. J Biomol Struct Dyn. 2019. PMID: 29493425

4

Novel chalcones derivatives with potential antineoplastic activity investigated by docking and molecular dynamics simulations.

Neto RAM, Santos CBR, Henriques SVC, Machado LO, Cruz JN, da Silva CHTP, Federico LB, Oliveira EHC, de Souza MPC, da Silva PNB, Taft CA, Ferreira IM, Gomes MRF. Neto RAM, et al. Among authors: federico lb. J Biomol Struct Dyn. 2022 Mar;40(5):2204-2216. doi: 10.1080/07391102.2020.1839562. Epub 2020 Nov 4. J Biomol Struct Dyn. 2022. PMID: 33146078

5

Identification of novel αβ-tubulin modulators with antiproliferative activity directed to cancer therapy using ligand and structure-based virtual screening.

Federico LB, Silva GM, de Fraga Dias A, Figueiró F, Battastini AMO, Dos Santos CBR, Costa LT, Rosa JMC, de Paula da Silva CHT. Federico LB, et al. Int J Biol Macromol. 2020 Dec 15;165(Pt B):3040-3050. doi: 10.1016/j.ijbiomac.2020.10.136. Epub 2020 Oct 22. Int J Biol Macromol. 2020. PMID: 33736292

6

Identification of known drugs as potential SARS-CoV-2 Mpro inhibitors using ligand- and structure-based virtual screening.

Federico LB, Silva GM, da Silva Hage-Melim LI, Gomes SQ, Barcelos MP, Galindo Francischini IA, Tomich de Paula da Silva CH. Federico LB, et al. Future Med Chem. 2021 Aug;13(16):1353-1366. doi: 10.4155/fmc-2021-0025. Epub 2021 Jun 25. Future Med Chem. 2021. PMID: 34169729 Free PMC article.

7

Revisiting the Proposition of Binding Pockets and Bioactive Poses for GSK-3β Allosteric Modulators Addressed to Neurodegenerative Diseases.

Silva GM, Borges RS, Santos KLB, Federico LB, Francischini IAG, Gomes SQ, Barcelos MP, Silva RC, Santos CBR, Silva CHTP. Silva GM, et al. Among authors: federico lb. Int J Mol Sci. 2021 Jul 31;22(15):8252. doi: 10.3390/ijms22158252. Int J Mol Sci. 2021. PMID: 34361017 Free PMC article.

8

GRIND2-based 3D-QSAR and prediction of activity spectra for symmetrical bis-pyridinium salts with promastigote antileishmanial activity.

Diniz EMLP, Tomich de Paula da Silva CH, Gómez-Perez V, Federico LB, Campos Rosa JM. Diniz EMLP, et al. Among authors: federico lb. J Biomol Struct Dyn. 2017 Aug;35(11):2430-2440. doi: 10.1080/07391102.2016.1221364. Epub 2016 Sep 6. J Biomol Struct Dyn. 2017. PMID: 27495391

9

In silico development of new acetylcholinesterase inhibitors.

Pascoini AL, Federico LB, Arêas ALF, Verde BA, Freitas PG, Camps I. Pascoini AL, et al. Among authors: federico lb. J Biomol Struct Dyn. 2019 Mar;37(4):1007-1021. doi: 10.1080/07391102.2018.1447513. Epub 2018 Apr 19. J Biomol Struct Dyn. 2019. PMID: 29607738

10

Virtual screening, ADME/Tox predictions and the drug repurposing concept for future use of old drugs against the COVID-19.

Hage-Melim LIDS, Federico LB, de Oliveira NKS, Francisco VCC, Correia LC, de Lima HB, Gomes SQ, Barcelos MP, Francischini IAG, da Silva CHTP. Hage-Melim LIDS, et al. Among authors: federico lb. Life Sci. 2020 Sep 1;256:117963. doi: 10.1016/j.lfs.2020.117963. Epub 2020 Jun 11. Life Sci. 2020. PMID: 32535080 Free PMC article.

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