Synthesis and biological properties of coumarin derivatives. A review A Bouhaoui, M Eddahmi, M Dib, M Khouili, A Aires, M Catto, L Bouissane ChemistrySelect 6 (24), 5848-5870, 2021 | 59 | 2021 |
Exploring the optoelectronic and third-order nonlinear optical susceptibility of cross-shaped molecules: insights from molecule to material level RA Shehzad, S Muhammad, J Iqbal, AG Al-Sehemi, M Yaseen, Z Aloui, ... Journal of Molecular Modeling 27, 1-10, 2021 | 36 | 2021 |
Norrish’type I and II reactions and their role in the building of photochemical science A Albini Photochemical & Photobiological Sciences 20 (1), 161-181, 2021 | 20 | 2021 |
Accurate estimation of enthalpies of formation for C-, H-, O-, and N-containing compounds using DLPNO-CCSD(T1)/CBS method OV Dorofeeva, ON Ryzhova Structural Chemistry 32, 553-563, 2021 | 15 | 2021 |
Theoretical analysis of the structural and electronic properties of the interaction of boron nitride diamantane nanocrystal with the drug hydroxyurea as an anticancer drug HO Muhsen, AOM Almayyali, AY Al-Mamoori, FF Mahmood Journal of Molecular Modeling 27, 1-9, 2021 | 10 | 2021 |
DFT investigation of Percyanation effect of coronene molecule: Comparative study with their Perhalogenated counterparts. MO Bouba, F Tchangnwa Nya, A Malloum, J Conradie, JM Ndjaka Polymer Bulletin 79 (11), 9663-9684, 2022 | 6 | 2022 |
Identification of new biologically active synthetic molecules: comparative experimental and theoretical studies on the structure-antioxidant activity relationship of cyclic 1 … RM Kerbadou, R Hadjadj Aoul, A Benmaati, A Taleb, S Hacini, ... Journal of Molecular Modeling 27, 1-12, 2021 | 5 | 2021 |
Study of N‐methyl‐5‐nitroindazolylacrylonitriles as a Function of Quantum Parameters Employing Density Function Theory Methods: Comparative Theoretical … A Moumad, A Bouhaoui, M Eddahmi, A Hafid, LR Domingo, L Bouissane ChemistrySelect 8 (14), e202300669, 2023 | 4 | 2023 |
Structure-property relationship of N-substituted triazolonitroindazoles: A comprehensive study on linear and non-linear optics, as a function of quantum parameters employing … A Moumad, A Bouhaoui, M Eddahmi, A Hafid, N Dege, MA Raza, ... Computational and Theoretical Chemistry 1233, 114510, 2024 | 1 | 2024 |
Theoretical study of the stability and reactivity of nitro-coumarins and amino-coumarins by DFT method A Bouhaoui, A Moumad, M Eddahmi, N Dege, MA Raza, L Bouissane Theoretical Chemistry Accounts 143 (1), 6, 2024 | 1 | 2024 |