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Synthesis, crystal structure, DFT, Hirshfeld surface analysis, energy framework, docking and molecular dynamic simulations of (E)-4-(4-methylbenzyl)-6-styrylpyridazin-3(2H)-one as anticancer agent.
El Kalai F, Çınar EB, Sert Y, Alhaji Isa M, Lai CH, Buba F, Dege N, Benchat N, Karrouchi K. El Kalai F, et al. Among authors: dege n. J Biomol Struct Dyn. 2023;41(21):11578-11597. doi: 10.1080/07391102.2022.2164796. Epub 2023 Jan 9. J Biomol Struct Dyn. 2023. PMID: 36617972
Crystal structure and Hirshfeld surface analysis of N-{2-[(E)-(4-methyl-benzyl-idene)amino]-phen-yl}-2-(5-methyl-1-H-pyrazol-3-yl)acetamide hemihydrate.
Chkirate K, Kansiz S, Karrouchi K, Mague JT, Dege N, Essassi EM. Chkirate K, et al. Among authors: dege n. Acta Crystallogr E Crystallogr Commun. 2019 Jan 8;75(Pt 2):154-158. doi: 10.1107/S2056989018017747. eCollection 2019 Feb 1. Acta Crystallogr E Crystallogr Commun. 2019. PMID: 30800442 Free PMC article.
Crystal structures and Hirshfeld surface analyses of 4-benzyl-6-phenyl-4,5-di-hydro-pyridazin-3(2H)-one and methyl 2-[5-(2,6-di-chloro-benz-yl)-6-oxo-3-phenyl-1,4,5,6-tetra-hydropyridazin-1-yl]acetate.
Dadou S, Kansiz S, Daoui S, El Kalai F, Baydere C, Saddik R, Karrouchi K, Dege N, Benchat N. Dadou S, et al. Among authors: dege n. Acta Crystallogr E Crystallogr Commun. 2019 Oct 22;75(Pt 11):1679-1684. doi: 10.1107/S2056989019013707. eCollection 2019 Nov 1. Acta Crystallogr E Crystallogr Commun. 2019. PMID: 31709089 Free PMC article.
160 results