Mohammed Bouachrine

@faculty of science meknes

Chemistry, Faculté of Science Meknes
moulay Ismail University

RESEARCH, TEACHING, or OTHER INTERESTS

Chemistry, Physical and Theoretical Chemistry, Organic Chemistry, Drug Guides
12006

Scholar Citations

52

Scholar h-index

289

Scholar i10-index

RECENT SCHOLAR PUBLICATIONS

  • Computational Design of Novel D-π-A-π-A Organic Sensitizers for DSSCs: Unveiling the Effect of Auxiliary Acceptor Groups
    A Azaid, M Bouachrine, T Abram, R Kacimi, M Elhadjaoui, R Marzouk, ...
    Physical Chemistry Research, e243460 , 2026
    2026
  • Computational investigation of bisquinoline derivatives as potential c-met kinase inhibitors: 3D-QSAR, molecular docking, dynamics simulations, and ADME-Tox studies
    M Boutalaka, M Ouabane, A Guendouzi, H Maghat, T Lakhlifi, ...
    Heliyon 12 (8) , 2026
    2026
  • Machine Learning Modeling of Olfactory Thresholds of Pyrazine Derivatives Using Cheminformatics Descriptors
    M Ouabane, K Zaki, A Sbai, T Lakhlifi, M Bouachrine
    RHAZES: Green and Applied Chemistry 24 , 2026
    2026
  • Computational Discovery of Novel PTP1B Inhibitors with Antidiabetic Potential
    L Naanaai, A El Aissouq, Y Ech-Chahdi, H Zaitan, M Bouachrine, F Khalil
    Moroccan Journal of Chemistry 14 (2), 600-620 , 2026
    2026
  • Comparative study on the photophysical properties of newly synthesized organic material based on poly (9-vinylcarbazole)(PVK) and poly (3-alkylthiophene) designed for a new …
    M Bouachrine, N Wazzan, A Kamel
    Journal of Materials Science: Materials in Electronics 37 (9), 643 , 2026
    2026
  • Computational investigation of medicinal plants’ active ingredient effects as a potential Zika virus treatment: molecular docking, molecular dynamics simulations, ADMET …
    F Elbamtari, E Belghalia, K Zaki, M Alaqarbeh, A Guendouzi, A Sbai, ...
    Journal of Molecular Modeling 32 (3), 61 , 2026
    2026
  • Bio-extracted chitosan-functionalized Mg–Al bimetallic as an innovative hybrid catalyst for green and sustainable synthesis of bioactive molecules with medicinal potential
    J Houssaini, EL M’hamed, H Ziyat, S Arhzaf, MN Bennani, M Bouachrine
    Journal of Organometallic Chemistry, 124090 , 2026
    2026
    Citations: 2
  • Integrated Computational Investigation of Cannabis sativa Phytoconstituents as Putative Multi-Target Inhibitors in Skin Cancer: A Molecular Docking, Dynamics …
    LE Bouamri, S Laaouina, I Lakrim, H Nour, I Yamari, A Samadi, ...
    Pharmaceuticals 19 (2), 315 , 2026
    2026
    Citations: 3
  • Moroccan virgin olive oil triterpenes: HPLC-DAD-ELSD profiling and computational investigation of anti-diabetic potential
    M Boutalaka, N Ouazzani, M Ouabane, P Stathopoulos, A Guendouzi, ...
    BioImpacts: BI 16, 31007 , 2026
    2026
  • Exploring Pyrazole and Spiropyrazoline Derivatives as Acetylcholinesterase Inhibitors for Alzheimer's Treatment: An In-Silico Study Combining Monte Carlo Optimization, HQSAR …
    A Sbai, MA El Alaouy, H Maghat, T Lakhlifi, M Bouachrine
    Moroccan Journal of Chemistry 14 (1), J. Chem. 14 (1)-135 , 2026
    2026
  • In silico studies of N-(4-tert-butylphenyl)-4-(3-chloropyridin-2-yl) piperazine-1-carboxamide derivatives as potent TRPV1 antagonists using 3D QSAR, ADMET and Molecular Docking
    A Toughzaoui, O Chedadi, A El Aissouq, Y El Ouardi, M Bouachrine, ...
    Journal of the Mexican Chemical Society, e2105-e2105 , 2026
    2026
  • Anticancer Activity in Heterocyclic Organic Structures: A Pathway to Novel Drug Development Part 1
    L El Mchichi, M Bouachrine, T Lakhlifi
    CRC Press , 2025
    2025
    Citations: 3
  • ZnO Nanocatalyst-Enabled Microwave-Assisted Solvent-Free Synthesis of Functional Amidoalkyl-2-naphthol Derivatives: A Synergistic Experimental and Quantum Chemical Study
    AR Daniel Aroquiaraj, P Vivekanandan, KS Satheeshkumar, ...
    ACS omega 10 (51), 62881-62894 , 2025
    2025
  • In Silico Study of (Hetero) arylidene-(4-substituted-thiazol-2-yl) Hydrazine Derivatives as hMAO-B Inhibitors: Development and Evaluation of QSAR Models Using Monte Carlo and …
    MA El Alaouy, KTA Sbai, H Maghat, T Lakhlifi, M Bouachrine
    Philippine Journal of Science 154 (6B), 1565-1589 , 2025
    2025
  • Computational study of new isatin molecules as potential Thymidine Phosphorylase (TP) inhibitors against cancer activity. 3D-QSAR, Molecular Docking, ADME-Tox, and molecular …
    R EL-Mernissi, M Alaqarbeh, A Khaldan, A Sbai, MA Ajana, T Lakhlifi, ...
    Journal of the Mexican Chemical Society 69 (4), 755-776 , 2025
    2025
    Citations: 1
  • Molecular insight, rational chemical design and computational assessment of thiazole-based DHODH inhibitors: from structural modelling to binding free energy calculations
    K Zaki, M Ouabane, A Guendouzi, M Alaqarbeh, A Sbai, C Sekkate, ...
    Journal of Biomolecular Structure and Dynamics, 1-22 , 2025
    2025
    Citations: 1
  • Synthesis, structural characterization, spectroscopic analyses, DFT-modeling, and RDG-NCI assessment of 4-dimethylaminopyridinium dihydrogen monophosphate
    L Guelmami, M Dhifet, K Zaki, N Alwadai, H Khmissi, M Bouzidi, ...
    Frontiers in Chemistry 13, 1701702 , 2025
    2025
    Citations: 5
  • DFT/TD-DFT-Guided Design of Conjugated Thiophene–Oxadiazole Donors for Organic Photovoltaics
    F Agda, M Messali, D Nebbach, A Sabik, M Alaqarbeh, N El Messaoudi, ...
    Materials Today Communications, 114318 , 2025
    2025
    Citations: 2
  • Integrated Experimental and Theoretical Exploration of Bioactive 2‐Naphthol‐Based Acetamides: Solvent‐Free Synthesis, DFT/NLO/QTAIM Characterization, and Protein‐Ligand Interaction
    P Vivekanandan, A Daniel Aroquiaraj, KS Satheeshkumar, ...
    ChemistrySelect 10 (43), e04491 , 2025
    2025
    Citations: 1
  • Design and Evaluation of Piperazine‐Based CB1 Antagonists as Promising Therapeutic Candidates for Obesity Treatment
    A Fakkahi, K Zaki, A Guendouzi, MA Ajana, A Sbai, T Lakhlifi, ...
    ChemistrySelect 10 (41), e04557 , 2025
    2025

MOST CITED SCHOLAR PUBLICATIONS

  • Moroccan Medicinal plants as inhibitors against SARS-CoV-2 main protease: Computational investigations
    I Aanouz, A Belhassan, K El-Khatabi, T Lakhlifi, M El-Ldrissi, ...
    Journal of Biomolecular Structure and Dynamics 39 (8), 2971-2979 , 2021
    2021
    Citations: 424
  • Thermodynamic characterisation of steel corrosion in HCl in the presence of 2-phenylthieno (3, 2-b) quinoxaline
    I El Ouali, B Hammouti, A Aouniti, Y Ramli, M Azougagh, EM Essassi, ...
    J. Mater. Environ. Sci 1 (1), 1-8 , 2010
    2010
    Citations: 195
  • Gravimetric, electrochemical and quantum chemical studies of some pyridazine derivatives as corrosion inhibitors for mild steel in 1 M HCl solution
    A Khadiri, R Saddik, K Bekkouche, A Aouniti, B Hammouti, N Benchat, ...
    Journal of the Taiwan Institute of Chemical Engineers 58, 552-564 , 2016
    2016
    Citations: 185
  • DFT and TD-DFT calculation of new thienopyrazine-based small molecules for organic solar cells
    M Bourass, AT Benjelloun, M Benzakour, M Mcharfi, M Hamidi, ...
    Chemistry Central Journal 10 (1), 67 , 2016
    2016
    Citations: 179
  • Dielectric properties, AC conductivity, and electric modulus analysis of bulk ethylcarbazole‐terphenyl
    H Bouaamlat, N Hadi, N Belghiti, H Sadki, M Naciri Bennani, F Abdi, ...
    Advances in Materials Science and Engineering 2020 (1), 8689150 , 2020
    2020
    Citations: 168
  • A theoretical study on the inhibition efficiencies of some quinoxalines as corrosion inhibitors of copper in nitric acid
    A Zarrouk, B Hammouti, A Dafali, M Bouachrine, H Zarrok, S Boukhris, ...
    Journal of Saudi Chemical Society 18 (5), 450-455 , 2014
    2014
    Citations: 168
  • Inhibitive properties, adsorption and theoretical study of 3, 7-dimethyl-1-(prop-2-yn-1-yl) quinoxalin-2 (1H)-one as efficient corrosion inhibitor for carbon steel in …
    A Zarrouk, H Zarrok, Y Ramli, M Bouachrine, B Hammouti, ...
    Journal of Molecular Liquids 222, 239-252 , 2016
    2016
    Citations: 166
  • A theoretical investigation on the corrosion inhibition of copper by quinoxaline derivatives in nitric acid solution
    A Zarrouk, H Zarrok, R Salghi, B Hammouti, SS Al-Deyab, R Touzani, ...
    International Journal of Electrochemical Science 7 (7), 6353-6364 , 2012
    2012
    Citations: 162
  • Corrosion inhibition of copper in nitric acid solutions using a new triazole derivative
    B Hammouti, H Zarrok, M Bouachrine, KF Khaled, SS Al-Deyab
    International Journal of Electrochemical Science 7 (1), 89-105 , 2012
    2012
    Citations: 154
  • Weight loss measurement and theoretical study of new pyridazine compound as corrosion inhibitor for C38 steel in hydrochloric acid solution
    H Zarrok, H Oudda, A Zarrouk, R Salghi, B Hammouti, M Bouachrine
    Der Pharma Chemica 3 (6), 576-590 , 2011
    2011
    Citations: 153
  • Evaluation of N-containing organic compound as corrosion inhibitor for carbon steel in phosphoric acid
    A Zarrouk, H Zarrok, R Salghi, B Hammouti, F Bentiss, R Touir, ...
    J Mater Environ Sci 4 (2), 177-192 , 2013
    2013
    Citations: 150
  • Theoretical investigation of new thiazolothiazole-based D-π-A organic dyes for efficient dye-sensitized solar cell
    A Fitri, AT Benjelloun, M Benzakour, M Mcharfi, M Hamidi, M Bouachrine
    Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 124, 646-654 , 2014
    2014
    Citations: 130
  • Density functional theory (B3LYP/6-31G*) study of oligothiophenes in their aromatic and polaronic states
    SM Bouzzine, S Bouzakraoui, M Bouachrine, M Hamidi
    Journal of Molecular Structure: THEOCHEM 726 (1-3), 271-276 , 2005
    2005
    Citations: 122
  • Weight loss, electrochemical, quantum chemical calculation, and molecular dynamics simulation studies on 2-(benzylthio)-1, 4, 5-triphenyl-1H-imidazole as an inhibitor for …
    DB Hmamou, R Salghi, A Zarrouk, MR Aouad, O Benali, H Zarrok, ...
    Industrial & Engineering Chemistry Research 52 (40), 14315-14327 , 2013
    2013
    Citations: 118
  • The role of acridin-9 (10H)-one in the inhibition of carbon steel corrosion: thermodynamic, electrochemical and DFT studies
    AH Al Hamzi, H Zarrok, A Zarrouk, R Salghi, B Hammouti, SS Al-Deyab, ...
    International Journal of Electrochemical Science 8 (2), 2586-2605 , 2013
    2013
    Citations: 118
  • Gravimetric and quantum chemical studies of 1-[4-acetyl-2-(4-chlorophenyl) quinoxalin-1 (4H)-yl] acetone as corrosion inhibitor for carbon steel in hydrochloric acid solution
    H Zarrok, A Zarrouk, R Salghi, H Oudda, B Hammouti, M Assouag, ...
    J Chem Pharm Res 4 (12), 5056-5066 , 2012
    2012
    Citations: 117
  • Thermodynamic characterisation and density functional theory investigation of 1, 1', 5, 5'-Tetramethyl-1H, 1'H-3, 3'-bipyrazole as corrosion inhibitor of C38 steel corrosion in HCl
    H Zarrok, SS Al-Deyab, A Zarrouk, R Salghi, B Hammouti, H Oudda, ...
    International Journal of Electrochemical Science 7 (5), 4047-4063 , 2012
    2012
    Citations: 113
  • A combined experimental and theoretical study on the corrosion inhibition and adsorption behaviour of quinoxaline derivative during carbon steel corrosion in hydrochloric acid
    H Zarrok, A Zarrouk, R Salghi, H Oudda, B Hammouti, M Ebn Touhami, ...
    Port. Electrochim. Acta 30 (6), 405-417 , 2012
    2012
    Citations: 104
  • Theoretical approach to the corrosion inhibition efficiency of some quinoxaline derivatives of steel in acid media using the DFT method
    A Zarrouk, I El Ouali, M Bouachrine, B Hammouti, Y Ramli, EM Essassi, ...
    Research on Chemical Intermediates 39 (3), 1125-1133 , 2013
    2013
    Citations: 103
  • Theoretical design of thiazolothiazole-based organic dyes with different electron donors for dye-sensitized solar cells
    A Fitri, AT Benjelloun, M Benzakour, M Mcharfi, M Hamidi, M Bouachrine
    Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 132, 232-238 , 2014
    2014
    Citations: 101