| QSAR, molecular docking and ADMET properties in silico studies of novel 4, 5, 6, 7-tetrahydrobenzo [D]-thiazol-2-Yl derivatives derived from dimedone as potent anti-tumor … O Daoui, S Elkhattabi, S Chtita, R Elkhalabi, H Zgou, AT Benjelloun Heliyon 7 (7), 2021 | 65 | 2021 |
| Virtual screening in drug-likeness and structure/activity relationship of pyridazine derivatives as Anti-Alzheimer drugs A Zerroug, S Belaidi, I BenBrahim, L Sinha, S Chtita Journal of King Saud University-Science 31 (4), 595-601, 2019 | 64 | 2019 |
| Identification of potent inhibitors of NEK7 protein using a comprehensive computational approach M Aziz, SA Ejaz, N Tamam, F Siddique, N Riaz, FA Qais, S Chtita, J Iqbal Scientific reports 12 (1), 6404, 2022 | 57 | 2022 |
| Discovery of potent SARS-CoV-2 inhibitors from approved antiviral drugs via docking and virtual screening S Chtita, A Belhassan, A Aouidate, S Belaidi, M Bouachrine, T Lakhlifi Combinatorial chemistry & high throughput screening 24 (3), 441-454, 2021 | 55 | 2021 |
| QSAR study of unsymmetrical aromatic disulfides as potent avian SARS-CoV main protease inhibitors using quantum chemical descriptors and statistical methods S Chtita, A Belhassan, M Bakhouch, AI Taourati, A Aouidate, S Belaidi, ... Chemometrics and Intelligent Laboratory Systems 210, 104266, 2021 | 53 | 2021 |
| Identification of a novel dual-target scaffold for 3CLpro and RdRp proteins of SARS-CoV-2 using 3D-similarity search, molecular docking, molecular dynamics and ADMET evaluation A Aouidate, A Ghaleb, S Chtita, M Aarjane, A Ousaa, H Maghat, A Sbai, ... Journal of Biomolecular Structure and Dynamics 39 (12), 4522-4535, 2021 | 52 | 2021 |
| Combined molecular docking and dynamics simulations studies of natural compounds as potent inhibitors against SARS-CoV-2 main protease M Ouassaf, S Belaidi, S Chtita, T Lanez, F Abul Qais, H Md Amiruddin Journal of Biomolecular Structure and Dynamics 40 (21), 11264-11273, 2022 | 50 | 2022 |
| Cameroonian medicinal plants as potential candidates of SARS-CoV-2 inhibitors RT Fouedjou, S Chtita, M Bakhouch, S Belaidi, M Ouassaf, ... Journal of Biomolecular Structure and Dynamics 40 (19), 8615-8629, 2022 | 46 | 2022 |
| In silico detection of potential inhibitors from vitamins and their derivatives compounds against SARS-CoV-2 main protease by using molecular docking, molecular dynamic … A Belhassan, S Chtita, H Zaki, M Alaqarbeh, N Alsakhen, F Almohtaseb, ... Journal of molecular structure 1258, 132652, 2022 | 45 | 2022 |
| Design of novel benzimidazole derivatives as potential α-amylase inhibitors using QSAR, pharmacokinetics, molecular docking, and molecular dynamics simulation studies O Abchir, O Daoui, S Belaidi, M Ouassaf, FA Qais, S ElKhattabi, ... Journal of Molecular Modeling 28 (4), 106, 2022 | 45 | 2022 |
| Camphor, Artemisinin and Sumac Phytochemicals as inhibitors against COVID-19: Computational approach A Belhassan, H Zaki, S Chtita, M Alaqarbeh, N Alsakhen, ... Computers in Biology and Medicine 136, 104758, 2021 | 45 | 2021 |
| Quantitative structure–activity relationship studies of dibenzo [a, d] cycloalkenimine derivatives for non-competitive antagonists of N-methyl-d-aspartate based on density … S Chtita, M Larif, M Ghamali, M Bouachrine, T Lakhlifi Journal of Taibah University for Science 9 (2), 143-154, 2015 | 41 | 2015 |
| QSAR analysis of the toxicity of phenols and thiophenols using MLR and ANN M Ghamali, S Chtita, A Ousaa, B Elidrissi, M Bouachrine, T Lakhlifi Journal of Taibah University for Science 11 (1), 1-10, 2017 | 40 | 2017 |
| Investigation of Antileishmanial Activities of Acridines Derivatives against Promastigotes and Amastigotes Form of Parasites Using Quantitative Structure Activity Relationship … S Chtita, M Ghamali, R Hmamouchi, B Elidrissi, M Bourass, M Larif, ... Advances in Physical Chemistry, 2016 | 40 | 2016 |
| QSAR study of N-substituted oseltamivir derivatives as potent avian influenza virus H5N1 inhibitors using quantum chemical descriptors and statistical methods S Chtita, A Aouidate, A Belhassan, A Ousaa, AI Taourati, B Elidrissi, ... New Journal of Chemistry 44 (5), 1747-1760, 2020 | 38 | 2020 |
| Prediction of biological activity of imidazo [1, 2-a] pyrazine derivatives by combining DFT and QSAR results S Chtita, M Ghamali, M Larif, A Adad, R Hmammouchi, M Bouachrine, ... International Journal of Innovative Research in Science, Engineering and …, 2013 | 38 | 2013 |
| Design, synthesis, characterization, in vitro screening, molecular docking, 3D-QSAR, and ADME-Tox investigations of novel pyrazole derivatives as antimicrobial agents M Chalkha, M Akhazzane, FZ Moussaid, O Daoui, A Nakkabi, ... New Journal of Chemistry 46 (6), 2747-2760, 2022 | 37 | 2022 |
| A computer-aided drug design approach to explore novel type II inhibitors of c-Met receptor tyrosine kinase for cancer therapy: QSAR, molecular docking, ADMET and molecular … O Daoui, H Nour, O Abchir, S Elkhattabi, M Bakhouch, S Chtita Journal of Biomolecular Structure and Dynamics 41 (16), 7768-7785, 2023 | 36 | 2023 |
| The inhibitory activity of aldose reductase of flavonoid compounds: Combining DFT and QSAR calculations M Ghamali, S Chtita, R Hmamouchi, A Adad, M Bouachrine, T Lakhlifi Journal of Taibah University for Science 10 (4), 534-542, 2016 | 36 | 2016 |
| 3D-QSAR, ADME-Tox, and molecular docking of semisynthetic triterpene derivatives as antibacterial and insecticide agents O Daoui, N Mazoir, M Bakhouch, M Salah, A Benharref, ... Structural Chemistry 33 (4), 1063-1084, 2022 | 35 | 2022 |
Mohammed BouachrineMoulay Ismail University, Faculty of Science Meknes, MoroccoAdresse e-mail validée de umi.ac.ma
