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1.
Molecular insight into endosulfan degradation by Ese protein from Arthrobacter: Evidence-based structural bioinformatics and quantum mechanical calculations.
Proteins
; 92(2): 302-313, 2024 Feb.
Artículo
en Inglés
| MEDLINE | ID: mdl-37864384
2.
Targeting Several Biologically Reported Targets of Glioblastoma Multiforme by Assaying 2D and 3D Cultured Cells.
Cell Mol Neurobiol
; 42(6): 1909-1920, 2022 Aug.
Artículo
en Inglés
| MEDLINE | ID: mdl-33740172
3.
Drug repositioning to target NSP15 protein on SARS-CoV-2 as possible COVID-19 treatment.
J Comput Chem
; 42(13): 897-907, 2021 05 15.
Artículo
en Inglés
| MEDLINE | ID: mdl-33713492
4.
Exploring the inhibitory activity of valproic acid against the HDAC family using an MMGBSA approach.
J Comput Aided Mol Des
; 34(8): 857-878, 2020 08.
Artículo
en Inglés
| MEDLINE | ID: mdl-32180123
5.
N-(2'-Hydroxyphenyl)-2-Propylpentanamide (HO-AAVPA) Inhibits HDAC1 and Increases the Translocation of HMGB1 Levels in Human Cervical Cancer Cells.
Int J Mol Sci
; 21(16)2020 Aug 16.
Artículo
en Inglés
| MEDLINE | ID: mdl-32824279
6.
Daidzein and Equol: Ex Vivo and In Silico Approaches Targeting COX-2, iNOS, and the Canonical Inflammasome Signaling Pathway.
Pharmaceuticals (Basel)
; 17(5)2024 May 16.
Artículo
en Inglés
| MEDLINE | ID: mdl-38794217
7.
Design and simulation of a caprylic acid enzymatically modified phosphatidylcholine micelle using a coarse-grained molecular dynamics simulations approach.
J Biomol Struct Dyn
; 41(23): 13902-13913, 2023.
Artículo
en Inglés
| MEDLINE | ID: mdl-36826442
8.
Cytotoxic evaluation of YSL-109 in a triple negative breast cancer cell line and toxicological evaluations.
Naunyn Schmiedebergs Arch Pharmacol
; 396(6): 1211-1222, 2023 06.
Artículo
en Inglés
| MEDLINE | ID: mdl-36694011
9.
HDAC Inhibition as Neuroprotection in COVID-19 Infection.
Curr Top Med Chem
; 22(16): 1369-1378, 2022.
Artículo
en Inglés
| MEDLINE | ID: mdl-35240959
10.
Computational study of DMPC liposomes loaded with the N-(2-Hydroxyphenyl)-2-propylpentanamide (HO-AAVPA) and determination of its antiproliferative activity in vitro in NIH-3T3 cells.
J Biomol Struct Dyn
; 40(21): 11448-11459, 2022.
Artículo
en Inglés
| MEDLINE | ID: mdl-34315332
11.
In silico design of HDAC6 inhibitors with neuroprotective effects.
J Biomol Struct Dyn
; 40(24): 14204-14222, 2022.
Artículo
en Inglés
| MEDLINE | ID: mdl-34784487
12.
Dihydropyrazole-Carbohydrazide Derivatives with Dual Activity as Antioxidant and Anti-Proliferative Drugs on Breast Cancer Targeting the HDAC6.
Pharmaceuticals (Basel)
; 15(6)2022 May 31.
Artículo
en Inglés
| MEDLINE | ID: mdl-35745608
13.
Structural insights into SARS-CoV-2 spike protein and its natural mutants found in Mexican population.
Sci Rep
; 11(1): 4659, 2021 02 25.
Artículo
en Inglés
| MEDLINE | ID: mdl-33633229
14.
Hydroxamic acid derivatives as HDAC1, HDAC6 and HDAC8 inhibitors with antiproliferative activity in cancer cell lines.
Sci Rep
; 10(1): 10462, 2020 06 26.
Artículo
en Inglés
| MEDLINE | ID: mdl-32591593
15.
DNA methylation of the RE-1 silencing transcription factor in peripheral blood mononuclear cells and gene expression of antioxidant enzyme in patients with late-onset Alzheimer disease.
Exp Gerontol
; 136: 110951, 2020 07 15.
Artículo
en Inglés
| MEDLINE | ID: mdl-32305596
16.
O-Alkyl Hydroxamates Display Potent and Selective Antileishmanial Activity.
J Med Chem
; 63(11): 5734-5751, 2020 06 11.
Artículo
en Inglés
| MEDLINE | ID: mdl-32392053
17.
Insights into structural features of HDAC1 and its selectivity inhibition elucidated by Molecular dynamic simulation and Molecular Docking.
J Biomol Struct Dyn
; 37(3): 584-610, 2019 Feb.
Artículo
en Inglés
| MEDLINE | ID: mdl-29447615
18.
Structural and energetic basis for the inhibitory selectivity of both catalytic domains of dimeric HDAC6.
J Biomol Struct Dyn
; 37(18): 4701-4720, 2019 11.
Artículo
en Inglés
| MEDLINE | ID: mdl-30558483
19.
Identification of the NADP+ Structural Binding Site and Coenzyme Effect on the Fused G6PD::6PGL Protein from Giardia lamblia.
Biomolecules
; 10(1)2019 12 27.
Artículo
en Inglés
| MEDLINE | ID: mdl-31892224
20.
Searching the conformational complexity and binding properties of HDAC6 through docking and molecular dynamic simulations.
J Biomol Struct Dyn
; 35(13): 2794-2814, 2017 Oct.
Artículo
en Inglés
| MEDLINE | ID: mdl-27589363