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DFT, ADMET and Molecular Docking Investigations for the Antimicrobial Activity of 6,6'-Diamino-1,1',3,3'-tetramethyl-5,5'-(4-chlorobenzylidene)bis[pyrimidine-2,4(1H,3H)-dione].
Molecules. 2022 Jan 18;27(3):620. doi: 10.3390/molecules27030620.
Molecules. 2022.
PMID: 35163880
Free PMC article.
Studying the Biological Activity of Trans-[Cu (quin)2(EtOH)2] as Potent Antimicrobial Cu(II) Complex through Computational Investigations: DFT, ADMET and Molecular Docking.
Hussein RK, El-Khayatt AM, Duaij OKA, Alkaoud AM.
Hussein RK, et al. Among authors: alkaoud am.
Front Biosci (Landmark Ed). 2023 Apr 27;28(4):84. doi: 10.31083/j.fbl2804084.
Front Biosci (Landmark Ed). 2023.
PMID: 37114549
Free article.
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In silico evaluation of a new compound incorporating 4(3H)-quinazolinone and sulfonamide as a potential inhibitor of a human carbonic anhydrase.
Alkaoud AM, Alakhras AI, Ibrahim MA, Alghamdi SK, Hussein RK.
Alkaoud AM, et al.
BMC Chem. 2024 Mar 4;18(1):45. doi: 10.1186/s13065-024-01150-1.
BMC Chem. 2024.
PMID: 38433188
Free PMC article.
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