Mohamed Ouabane

ADMET profiling and molecular docking of pyrazole and pyrazolines derivatives as antimicrobial agents

Fatima En-Nahli, Halima Hajji, Mohamed Ouabane et al. · Arabian Journal of Chemistry · 2023 · 29 citations · Full text

Structure-odor relationship in pyrazines and derivatives: A physicochemical study using 3D-QSPR, HQSPR, Monte Carlo, molecular docking, ADME-Tox and molecular dynamics

Mohamed Ouabane, Kamal Tabti, Halima Hajji et al. · Arabian Journal of Chemistry · 2023 · 26 citations · Full text

Medicinal Chemistry, Engineering, Chemical Analysis +15

Molecular toxicity of nitrobenzene derivatives to tetrahymena pyriformis based on SMILES descriptors using Monte Carlo, docking, and MD simulations

Mohamed Ouabane, Khadija Zaki, Kamal Tabti et al. · Computers in Biology and Medicine · 2023 · 23 citations

Combinatorial Chemistry, Chemical Analysis, Organic Chemistry +16

From farm to pharma: Investigation of the therapeutic potential of the dietary plants Apium graveolens L., Coriandrum sativum, and Mentha longifolia, as AhR modulators for Immunotherapy

Khadija Zaki, Mohamed Ouabane, Abdelkrim Guendouzi et al. · Computers in Biology and Medicine · 2024 · 18 citations

Computational Prediction of 3,5-Diaryl-1H-Pyrazole and spiropyrazolines derivatives as potential acetylcholinesterase inhibitors for alzheimer disease treatment by 3D-QSAR, molecular docking, molecular dynamics simulation, and ADME-Tox

Moulay Ahfid El Alaouy, Marwa Alaqarbeh, Mohamed Ouabane et al. · Journal of Biomolecular Structure and Dynamics · 2023 · 16 citations