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Synthesis, Biological Activity Evaluation and Molecular Docking of Imidazole Derivatives Possessing Hydrazone Moiety.
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- Chemistry & Biodiversity, 2023, v. 20, n. 6, p. 1, doi. 10.1002/cbdv.202200886
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- Article
The Impact of D614G Mutation of SARS-COV-2 on the Efficacy of Anti-viral Drugs: A Comparative Molecular Docking and Molecular Dynamics Study.
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- Current Microbiology, 2022, v. 79, n. 8, p. 1, doi. 10.1007/s00284-022-02921-6
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- Article
Theoretical evaluation of triazine derivatives as steel corrosion inhibitors: DFT and Monte Carlo simulation approaches.
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- Research on Chemical Intermediates, 2016, v. 42, n. 5, p. 4963, doi. 10.1007/s11164-015-2339-0
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Advanced evaluation of novel quinoline derivatives for corrosion inhibition of mild steel in acidic environments: A comprehensive electrochemical, computational, and surface study.
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- International Journal of Electrochemical Science, 2024, v. 19, n. 10, p. 1, doi. 10.1016/j.ijoes.2024.100772
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- Article
SYNTHESIS, MOLECULAR MODELLING AND CHOLINE ESTERASE ENZYME INHIBITORY ACTIVITY OF NOVEL ENAMINONE DERIVATIVES OF SULFONAMIDES.
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- Bulletin of the Chemical Society of Ethiopia, 2024, v. 38, n. 5, p. 1351, doi. 10.4314/bcse.v38i5.13
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Comparative study of experimental and DFT calculations for 3-cinnamoyl 4-hydroxycoumarin derivatives.
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- Technology & Health Care, 2024, v. 32, n. 4, p. 2673, doi. 10.3233/THC-231798
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Mathematical Modeling of the Biological Activity of a New Complex Compound Based on Palladium and Mexidol.
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- Journal of Biochemical Technology, 2023, v. 14, n. 1, p. 40, doi. 10.51847/ksxuz54Cjf
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- Article
Peripheral (E)‐2‐[(4‐hydroxybenzylidene)‐3,4‐dihydronaphthalen‐1(2H)‐one)]‐coordinated phthalocyanines with improved enzyme inhibition properties and photophysicochemical behaviors.
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- Archiv der Pharmazie, 2024, v. 357, n. 9, p. 1, doi. 10.1002/ardp.202400209
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Synthesis, biological activities, and molecular docking studies of triazolo[4,3‐b]triazine derivatives as a novel class of α‐glucosidase and α‐amylase inhibitors.
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- Archiv der Pharmazie, 2024, v. 357, n. 7, p. 1, doi. 10.1002/ardp.202300628
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Synthesis, molecular docking, and biological activities of new cyanopyridine derivatives containing phenylurea.
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- Archiv der Pharmazie, 2021, v. 354, n. 4, p. 1, doi. 10.1002/ardp.202000334
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Determination of the inhibition profiles of pyrazolyl–thiazole derivatives against aldose reductase and α‐glycosidase and molecular docking studies.
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- Archiv der Pharmazie, 2020, v. 353, n. 12, p. 1, doi. 10.1002/ardp.202000118
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- Article
Quinoline‐fused both non‐peripheral and peripheral Zn<sup>II</sup> and Mg<sup>II</sup> phthalocyanines: Anti‐cholinesterase, anti‐α‐glucosidase, DNA nuclease, antioxidant activities, and in silico studies.
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- Applied Organometallic Chemistry, 2022, v. 36, n. 7, p. 1, doi. 10.1002/aoc.6696
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Octa‐substituted Zinc(II), Cu(II), and Co(II) phthalocyanines with 1‐(4‐hydroxyphenyl)propane‐1‐one: Synthesis, sensitive protonation behaviors, Ag(I) induced H‐type aggregation properties, antibacterial–antioxidant activity, and molecular docking studies
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- Applied Organometallic Chemistry, 2021, v. 35, n. 10, p. 1, doi. 10.1002/aoc.6353
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Synthesis of (4R)‐2‐(3‐hydroxyphenyl)thiazolidine‐4‐carboxylic acid substituted phthalocyanines: Anticancer activity on different cancer cell lines and molecular docking studies.
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- Applied Organometallic Chemistry, 2021, v. 35, n. 7, p. 1, doi. 10.1002/aoc.6242
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- Article
Turn‐on fluorescent probe for Zn<sup>2+</sup> ions based on thiazolidine derivative.
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- Applied Organometallic Chemistry, 2020, v. 34, n. 6, p. 1, doi. 10.1002/aoc.5624
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Synthesis, Spectroscopic Characterization, Antibacterial Activity, and Computational Studies of Novel Pyridazinone Derivatives.
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- Molecules, 2023, v. 28, n. 2, p. 678, doi. 10.3390/molecules28020678
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- Article
Promising Insecticidal Properties of Essential Oils from Artemisia aragonensis Lam. and Artemisia negrei L. (Asteraceae) by Targeting Gamma-Aminobutyric Acid and Ryanodine Receptor Proteins: In Vitro and In Silico Approaches.
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- Separations (2297-8739), 2023, v. 10, n. 6, p. 329, doi. 10.3390/separations10060329
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Synthesis of new carboxylates and sulfonates containing thiazolidin-4-one ring and evaluation of inhibitory properties against some metabolic enzymes.
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- Journal of the Iranian Chemical Society, 2023, v. 20, n. 10, p. 2631, doi. 10.1007/s13738-023-02861-3
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Molecular docking and 4D-QSAR model of methanone derivatives by electron conformational-genetic algorithm method.
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- Journal of the Iranian Chemical Society, 2020, v. 17, n. 5, p. 985, doi. 10.1007/s13738-019-01835-8
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3D‐QSAR, molecular docking, molecular dynamics, and ADME/T analysis of marketed and newly designed flavonoids as inhibitors of Bcl‐2 family proteins for targeting U‐87 glioblastoma.
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- Journal of Cellular Biochemistry, 2022, v. 123, n. 2, p. 390, doi. 10.1002/jcb.30178
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The synthesis of novel unnatural amino acid by intramolecular aza‐Michael addition reaction as multitarget enzyme inhibitors.
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- Journal of Biochemical & Molecular Toxicology, 2024, v. 38, n. 9, p. 1, doi. 10.1002/jbt.23837
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Piperazin incorporated Schiff Base derivatives: Assessment of in vitro biological activities, metabolic enzyme inhibition properties, and molecular docking calculations.
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- Journal of Biochemical & Molecular Toxicology, 2023, v. 37, n. 11, p. 1, doi. 10.1002/jbt.23465
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Novel amino acid Schiff base Zn(II) complexes as new therapeutic approaches in diabetes and Alzheimer's disease: Synthesis, characterization, biological evaluation, and molecular docking studies.
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- Journal of Biochemical & Molecular Toxicology, 2022, v. 36, n. 3, p. 1, doi. 10.1002/jbt.22969
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Synthesis of 1,3‐Disubtitituted Tetrahydropyrimidinium Salts and Determination of Their Biological Properties and Molecular Docking.
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- ChemistrySelect, 2024, v. 9, n. 19, p. 1, doi. 10.1002/slct.202304440
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Isofraxidin: Antioxidant, Anti‐carbonic Anhydrase, Anti‐cholinesterase, Anti‐diabetic, and in Silico Properties.
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- ChemistrySelect, 2023, v. 8, n. 34, p. 1, doi. 10.1002/slct.202300170
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Synthesis, Molecular Docking and Antiproliferative Activity Studies of a Thiazole‐Based Compound Linked to Hydrazone Moiety.
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- ChemistrySelect, 2022, v. 7, n. 26, p. 1, doi. 10.1002/slct.202201502
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In Silico and In Vitro Antiproliferative Activity Assessment of New Schiff Bases.
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- ChemistrySelect, 2022, v. 7, n. 3, p. 1, doi. 10.1002/slct.202103679
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- Article
Repositioning of acefylline as anti-cancer drug: Synthesis, anticancer and computational studies of azomethines derived from acefylline tethered 4-amino-3-mercapto-1,2,4-triazole.
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- PLoS ONE, 2022, v. 17, n. 12, p. 1, doi. 10.1371/journal.pone.0278027
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EXPERIMENTAL AND THEORETICAL INVESTIGATION OF ANTIOXIDANT ACTIVITY OF SOME DERIVATIVES WITH COUMARIN SCAFFOLD.
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- Farmacia, 2023, v. 71, n. 2, p. 359, doi. 10.31925/farmacia.2023.2.16
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