Detalhe da pesquisa
1.
Accelerating Big Data Analysis through LASSO-Random Forest Algorithm in QSAR Studies.
Bioinformatics
; 38(2): 469-475, 2022 01 03.
Artigo
em Inglês
| MEDLINE | ID: mdl-34979024
2.
Discovery of novel direct small-molecule inhibitors targeting HIF-2α using structure-based virtual screening, molecular dynamics simulation, and MM-GBSA calculations.
Mol Divers
; 2023 Apr 29.
Artigo
em Inglês
| MEDLINE | ID: mdl-37120484
3.
Design, Synthesis, Molecular Docking, and Molecular Dynamics Simulation Studies of Novel 3-Hydroxypyridine-4-one Derivatives as Potential Acetylcholinesterase Inhibitors.
Chem Biodivers
; 20(7): e202300325, 2023 Jul.
Artigo
em Inglês
| MEDLINE | ID: mdl-37347200
4.
Synthesis of Some Benzothiazole Derivatives Based on 3-Hydroxypyridine-4-one and Benzaldehyde and Evaluation of Their ß-Amyloid Aggregation Inhibition Using both Experimental Methods and Molecular Dynamic Simulation.
Chem Biodivers
; 20(10): e202301113, 2023 Oct.
Artigo
em Inglês
| MEDLINE | ID: mdl-37691012
5.
Design, synthesis, in silico studies, and antiproliferative evaluations of novel indolin-2-one derivatives containing 3-hydroxy-4-pyridinone fragment.
Bioorg Med Chem Lett
; 70: 128784, 2022 08 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-35569690
6.
A Comparative DFT Study on the Antioxidant Activity of Some Novel 3-Hydroxypyridine-4-One Derivatives.
Chem Biodivers
; 19(3): e202100703, 2022 Mar.
Artigo
em Inglês
| MEDLINE | ID: mdl-34997823
7.
MTX-Loaded Dual Thermoresponsive and pH-Responsive Magnetic Hydrogel Nanocomposite Particles for Combined Controlled Drug Delivery and Hyperthermia Therapy of Cancer.
Mol Pharm
; 18(1): 275-284, 2021 01 04.
Artigo
em Inglês
| MEDLINE | ID: mdl-33300343
8.
Design, Synthesis and Molecular Docking Studies of Some Tetrahydropyrimidine Derivatives as Possible Fascin Inhibitors.
Chem Biodivers
; 16(2): e1800339, 2019 Feb.
Artigo
em Inglês
| MEDLINE | ID: mdl-30284762
9.
Design and Synthesis of Novel Cytotoxic Indole-Thiosemicarbazone Derivatives: Biological Evaluation and Docking Study.
Chem Biodivers
; 16(4): e1800470, 2019 Apr.
Artigo
em Inglês
| MEDLINE | ID: mdl-30845369
10.
HIV-1 Entry Inhibitors: A Review of Experimental and Computational Studies.
Chem Biodivers
; 15(10): e1800159, 2018 Oct.
Artigo
em Inglês
| MEDLINE | ID: mdl-30027572
11.
Novel Catechol Derivatives of Arylimidamides as Antileishmanial Agents.
Chem Biodivers
; 15(10): e1800228, 2018 Oct.
Artigo
em Inglês
| MEDLINE | ID: mdl-29999602
12.
Design, Synthesis, and Anti-HIV-1 Evaluation of a Novel Series of 1,2,3,4-Tetrahydropyrimidine-5-Carboxylic Acid Derivatives.
Chem Biodivers
; 15(4): e1700502, 2018 Apr.
Artigo
em Inglês
| MEDLINE | ID: mdl-29411517
13.
The role of different sampling methods in improving biological activity prediction using deep belief network.
J Comput Chem
; 38(4): 195-203, 2017 02 05.
Artigo
em Inglês
| MEDLINE | ID: mdl-27862046
14.
Synthesis, Biological Evaluation, and Molecular Docking Studies of Novel 4-[4-Arylpyridin-1(4H)-yl]benzoic Acid Derivatives as Anti-HIV-1 Agents.
Chem Biodivers
; 14(12)2017 Dec.
Artigo
em Inglês
| MEDLINE | ID: mdl-28834275
15.
Elucidation of Molecular Mechanisms Behind the Self-Assembly Behavior of Chitosan Amphiphilic Derivatives Through Experiment and Molecular Modeling.
Pharm Res
; 32(12): 3899-915, 2015 Dec.
Artigo
em Inglês
| MEDLINE | ID: mdl-26264510
16.
Hantzsch-Type dihydropyridines and Biginelli-type tetra-hydropyrimidines: a review of their chemotherapeutic activities.
J Pharm Pharm Sci
; 18(1): 1-52, 2015.
Artigo
em Inglês
| MEDLINE | ID: mdl-25877440
17.
Poly[N-(2-aminoethyl)ethyleneimine] as a new non-viral gene delivery carrier: the effect of two protonatable nitrogens in the monomer unit on gene delivery efficiency.
J Pharm Pharm Sci
; 17(4): 461-74, 2014.
Artigo
em Inglês
| MEDLINE | ID: mdl-25579429
18.
New 3-Hydroxypyridine-4-one Analogues: Their Synthesis, Antimicrobial Evaluation, Molecular Docking, and In Silico ADME Prediction.
Med Chem
; 2024 Jun 04.
Artigo
em Inglês
| MEDLINE | ID: mdl-38840401
19.
Computational evaluation of some indenopyrazole derivatives as anticancer compounds; application of QSAR and docking methodologies.
J Enzyme Inhib Med Chem
; 28(1): 16-32, 2013 Feb.
Artigo
em Inglês
| MEDLINE | ID: mdl-21999517
20.
Wound healing by topical application of antioxidant iron chelators: kojic acid and deferiprone.
Int Wound J
; 10(3): 260-4, 2013 Jun.
Artigo
em Inglês
| MEDLINE | ID: mdl-22621771