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King Fahd University of Petroleum and Minerals
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50 articles.
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1. Structural activity, spectroscopic, Fukui, NCI, AIM, IGM combined with molecular docking and molecular dynamics simulation on 4-methylpyridinium 4-hydroxybenzoate-potent drug anti-leukemia cancer;Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy;2024-02
2. Computational studies into the chemical nature, thermal behaviour, solvent role, reactivity and biological evaluation of Rigidin E – A marine alkaloid with potent liver cancer inhibition;Journal of Molecular Liquids;2023-12
3. Structure of molecule, density gradient, orbital locator and reactivity of 5,6-dichloro-1-cyclopentyl-2-(methylsulfinyl)-1H-benzimidazole- potent inhibitor of map kinase;Journal of Molecular Structure;2023-10
4. Solvent-solute polarity, electrophilic, steric effects, reactive sites, themodynamic quantities discussion and biological evaluation of lung cancer antiproliferative activities of spirobrassinin derivatives;Journal of Molecular Liquids;2023-09
5. Spirocyclic isatin-derivative analogues: Solvation, structural, electronic, topological, reactivity properties, and anti-leukaemic biological evaluation;Computational and Theoretical Chemistry;2023-07