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Page 1
Investigation of photophysical and electronic properties of aurone derivatives: Insights from spectroscopic techniques and density functional theory calculations.
Ullah Mughal E, Roufieda Guerroudj A, Bozkurt E, Naeem N, Sadiq A, Al-Fahemi JH, Jassas RS, Hussein EM, Boukabcha N, Chouaih A, Ahmed SA. Ullah Mughal E, et al. Among authors: chouaih a. Spectrochim Acta A Mol Biomol Spectrosc. 2023 Dec 5;302:123130. doi: 10.1016/j.saa.2023.123130. Epub 2023 Jul 11. Spectrochim Acta A Mol Biomol Spectrosc. 2023. PMID: 37517274
Conformation and vibrational spectroscopic analysis of 2,6-bis(4-fluorophenyl)-3,3-dimethylpiperidin-4-one (BFDP) by DFT method: A potent anti-Parkinson's, anti-lung cancer, and anti-human infectious agent.
Arumugam T, Ramalingam A, Guerroudj AR, Sambandam S, Boukabcha N, Chouaih A. Arumugam T, et al. Among authors: chouaih a. Heliyon. 2023 Oct 29;9(11):e21315. doi: 10.1016/j.heliyon.2023.e21315. eCollection 2023 Nov. Heliyon. 2023. PMID: 37954314 Free PMC article.
Experimental spectral characterization, Hirshfeld surface analysis, DFT/TD-DFT calculations and docking studies of (2Z,5Z)-5-(4-nitrobenzylidene)-3-N(2-methoxyphenyl)-2-N'(2-methoxyphenylimino) thiazolidin-4-one.
Djafri A, Perveen F, Benhalima N, Khelloul N, Rahmani R, Djafri A, Chouaih A, Kanoun MB, Goumri-Said S. Djafri A, et al. Among authors: chouaih a. Heliyon. 2020 Dec 22;6(12):e05754. doi: 10.1016/j.heliyon.2020.e05754. eCollection 2020 Dec. Heliyon. 2020. PMID: 33385082 Free PMC article.
Exploring Pyrimidine-Based azo Dyes: Vibrational spectroscopic Assignments, TD-DFT Investigation, chemical Reactivity, HOMO-LUMO, ELF, LOL and NCI-RDG analysis.
Roufieda Guerroudj A, Ullah Mughal E, Naeem N, Sadiq A, Al-Fahemi JH, Asghar BH, Boukabcha N, Chouaih A, Ahmed SA. Roufieda Guerroudj A, et al. Among authors: chouaih a. Spectrochim Acta A Mol Biomol Spectrosc. 2024 May 15;313:124093. doi: 10.1016/j.saa.2024.124093. Epub 2024 Feb 28. Spectrochim Acta A Mol Biomol Spectrosc. 2024. PMID: 38428162
Mol-ecular and crystal structure, Hirshfeld analysis and DFT investigation of 5-(furan-2-yl-methyl-idene)thia-zolo[3,4-a]benzimidazole-2-thione.
Khaldi H, Djafri A, Megrouss Y, Khelloul N, Chouaih A, Djafri A. Khaldi H, et al. Among authors: chouaih a. Acta Crystallogr E Crystallogr Commun. 2020 Nov 13;76(Pt 12):1832-1836. doi: 10.1107/S2056989020015017. eCollection 2020 Dec 1. Acta Crystallogr E Crystallogr Commun. 2020. PMID: 33520263 Free PMC article.
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