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Assessment of the in vitro anti-diabetic activity with molecular dynamic simulations of limonoids isolated from Adalia lemon peels.
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- Scientific Reports, 2024, v. 14, n. 1, p. 1, doi. 10.1038/s41598-024-71198-5
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- Article
Nano-Liposomal Beetroot Phyto-Pigment in Photodynamic Therapy as a Prospective Green Approach for Cancer Management: In Vitro Evaluation and Molecular Dynamic Simulation.
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- Pharmaceutics, 2024, v. 16, n. 8, p. 1038, doi. 10.3390/pharmaceutics16081038
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- Article
Synthesis of novel heterocyclic compounds based on dialdehyde cellulose: characterization, antimicrobial, antitumor activity, molecular dynamics simulation and target identification.
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- Cellulose, 2021, v. 28, n. 13, p. 8355, doi. 10.1007/s10570-021-04063-7
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- Article
Phytochemical Investigation of Cordia africana Lam. Stem Bark: Molecular Simulation Approach.
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- Molecules, 2022, v. 27, n. 13, p. 4039, doi. 10.3390/molecules27134039
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- Article
Coupling of HSP72 α-Helix Subdomains by the Unexpected Irreversible Targeting of Lysine-56 over Cysteine-17; Coevolution of Covalent Bonding.
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- Molecules, 2020, v. 25, n. 18, p. 4239, doi. 10.3390/molecules25184239
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- Article
New Benzimidazoles and Their Antitumor Effects with Aurora A Kinase and KSP Inhibitory Activities.
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- Archiv der Pharmazie, 2015, v. 348, n. 7, p. 475, doi. 10.1002/ardp.201400441
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- Article
Sterols and flavonoids in strawberry calyx with free radical scavenging, anti-inflammatory, and molecular dynamic study.
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- Beni-Suef University Journal of Basic & Applied Sciences, 2023, v. 12, n. 1, p. 1, doi. 10.1186/s43088-023-00445-x
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- Article
Benzimidazole – Schiff bases and their complexes: synthesis, anticancer activity and molecular modeling as Aurora kinase inhibitor.
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- Zeitschrift für Naturforschung. Section C: A Journal of Biosciences, 2018, v. 73, n. 11/12, p. 465, doi. 10.1515/znc-2018-0010
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- Article
Role of Alpha Lipoic Acid on Metabolic Hepatosteatosis: An Experimental, Biochemical, and Microscopic Study.
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- Egyptian Journal of Hospital Medicine, 2015, v. 61, p. 489, doi. 10.12816/0018753
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- Article
Morphological, physio-biochemical and nutritional status as potential markers for grafting compatibility in Kalamata olive cultivar.
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- BMC Plant Biology, 2023, v. 23, n. 1, p. 1, doi. 10.1186/s12870-023-04346-0
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- Article
Antiviral Potentialities of Chemical Characterized Essential Oils of Acacia nilotica Bark and Fruits against Hepatitis A and Herpes Simplex Viruses: In Vitro , In Silico, and Molecular Dynamics Studies.
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- Plants (2223-7747), 2022, v. 11, n. 21, p. 2889, doi. 10.3390/plants11212889
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- Article
Covalent Versus Non-covalent Enzyme Inhibition: Which Route Should We Take? A Justification of the Good and Bad from Molecular Modelling Perspective.
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- Protein Journal, 2020, v. 39, n. 2, p. 97, doi. 10.1007/s10930-020-09884-2
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- Article
A Synergistic Combination Against Chronic Myeloid Leukemia: An Intra-molecular Mechanism of Communication in BCR–ABL1 Resistance.
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- Protein Journal, 2019, v. 38, n. 2, p. 142, doi. 10.1007/s10930-019-09820-z
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- Article
Biosynthesis and Characterization of Gold and Copper Nanoparticles from Salvadora persica Fruit Extracts and Their Biological Properties.
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- International Journal of Nanomedicine, 2022, v. 17, p. 6095, doi. 10.2147/IJN.S385543
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- Article
New Indazol-Pyrimidine-Based Derivatives as Selective Anticancer Agents: Design, Synthesis, and In Silico Studies.
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- Molecules, 2023, v. 28, n. 9, p. 3664, doi. 10.3390/molecules28093664
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- Article
Salvimulticanol from Salvia multicaulis suppresses LPS-induced inflammation in RAW264.7 macrophages: in vitro and in silico studies.
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- 3 Biotech, 2024, v. 14, n. 5, p. 1, doi. 10.1007/s13205-024-03987-8
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- Article
Co-application of proline or calcium and humic acid enhances productivity of salt stressed pomegranate by improving nutritional status and osmoregulation mechanisms.
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- Scientific Reports, 2022, v. 12, n. 1, p. 1, doi. 10.1038/s41598-022-17824-6
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- Article
MITIGATION OF EXCESSIVE SOLAR RADIATION AND WATER STRESS ON 'KEITT' MANGO Mangifera indica TREES THROUGH SHADING.
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- Acta Scientiarum Polonorum. Hortorum Cultus, 2021, v. 20, n. 4, p. 77, doi. 10.24326/asphc.2021.4.7
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- Article
LC-MS/MS profiling of Tipuana tipu flower, HPLC-DAD quantification of its bioactive components, and interrelationships with antioxidant, and anti-inflammatory activity: in vitro and in silico approaches.
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- BMC Complementary Medicine & Therapies, 2024, v. 24, n. 1, p. 1, doi. 10.1186/s12906-024-04467-5
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- Article
Combinative effects of akarkara root-derived metabolites on anti-inflammatory and anti-alzheimer key enzymes: integrating bioassay-guided fractionation, GC-MS analysis, and in silico studies.
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- BMC Complementary Medicine & Therapies, 2023, v. 23, n. 1, p. 1, doi. 10.1186/s12906-023-04210-6
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- Article
Modulatory Effect of Pyrus pyrifolia Fruit and its Phenolics on Key Enzymes against Metabolic Syndrome: Bioassay-Guided Approach, HPLC Analysis, and In Silico Study.
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- Plant Foods for Human Nutrition, 2023, v. 78, n. 2, p. 383, doi. 10.1007/s11130-023-01069-3
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- Article
Arabic gum/chitosan/Zn–NPs composite film maintains the quality of Hass avocado fruit by delaying ripening and activating enzymatic defense mechanisms.
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- Scientific Reports, 2024, v. 13, n. 1, p. 1, doi. 10.1038/s41598-023-50642-y
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- Article
Facile and Novel Synthetic Approach, Molecular Docking, Molecular Dynamics, and Drug‐Likeness Evaluation of 9‐Substituted Acridine Derivatives as Dual Anticancer and Antimicrobial Agents.
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- Chemistry & Biodiversity, 2024, v. 21, n. 5, p. 1, doi. 10.1002/cbdv.202301986
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- Article
Dual Drug Targeting of Mutant Bcr‐Abl Induces Inactive Conformation: New Strategy for the Treatment of Chronic Myeloid Leukemia and Overcoming Monotherapy Resistance.
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- Chemistry & Biodiversity, 2018, v. 15, n. 3, p. 1, doi. 10.1002/cbdv.201700533
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- Article