Productions scientifiques

26 résultats RSS CSV XLSX BibTeX

Trier:Pertinence Plus récent Plus ancien Titre Plus cités

Multi-combined 3D-QSAR, docking molecular and ADMET prediction of 5-azaindazole derivatives as LRRK2 tyrosine kinase inhibitors

Saida Khamoulı, Salah Belaıdı, Mebarka Ouassaf, Touhami Lanez, Saïd Belaaouad, Samir Chtita

Journal of Biomolecular Structure and DynamicsVolume 40، (3)، Pages 1285-12982020Article Accès fermé 31

Synthesis, molecular docking, drug‐likeness analysis, and ADMET prediction of nickel and zinc tetraphenyl‐porphyrin complexes as possible antioxidant agents

Elhafnaoui Lanez, Lalmi Zerrouk, Lazhar Bechki, Touhami Lanez, Aicha Adaika, Nadjiba Zegheb, Kaouther Nesba

Journal of the Chinese Chemical SocietyVolume 71، (10)، Pages 1211-12292024Article Accès fermé 13

Novel therapeutic agents for H5N1 influenza virus through 3D-QSAR, molecular docking, ADMET prediction, and DFT based global reactivity descriptors

Afaf Zekri, Mebarka Ouassaf, Shafi Ullah Khan, Aicha Kerassa, Bader Y. Alhatlani

Journal of the Indian Chemical SocietyVolume 101، (11)، Pages 1013732024Article Accès fermé 4

Anti‐Diabetic Activity of Flavonol Glucosides From Fumana montana Pomel: In vitro Analysis, In Silico Docking, ADMET Prediction, and Molecular Dynamics Simulations

Habiba Laraoui, Elhafnaoui Lanez, Nadjiba Zegheb, Aicha Adaika, Touhami Lanez, Mohammed Benkhaled

ChemistrySelectVolume 8، (8)2023Article Accès ouvert 15

Computer-Aided Strategy on 5-(Substituted benzylidene) Thiazolidine-2,4-Diones to Develop New and Potent PTP1B Inhibitors: QSAR Modeling, Molecular Docking, Molecular Dynamics, PASS Predictions, and DFT Investigations

Nour-El Houda Derki, Aicha Kerassa, Salah Belaıdı, Maroua Derki, Imane Yamari, Abdelouahid Samadi, Samir Chtita

MoleculesVolume 29، (4)، Pages 8222024Article Accès ouvert 7

Holistic investigation of Cotula cinerea essential oil against diabetes: hypoglycemic activity, enzymatic inhibition, GC-MS characterization, ADMET forecasting, MD simulations, and DFT insights

Ouafa Boudebia, Mohammed Larbi Benamor, Lotfi Bourougaa, Yahia Bekkar, Elhafnaoui Lanez, Aicha Adaika, Rania Bouraoui, Kaouther Nesba, Housseyn Chaoua, Salah Eddine Hachani et 2 autres

Journal of Computer-Aided Molecular DesignVolume 39، (1)، Pages 802025Chapitre Accès fermé 16

GC/MS analysis and computational evaluation of C. cinerea EO constituents for colorectal cancer: Molecular docking, dynamics, and quantum chemical insights into Cis-Verbenyl acetate

Bouchagra Samah, Elhafnaoui Lanez, Mohammed Larbi Benamor, Yahia Bekkar, Salah Neghmouche Nacer, Lotfi Bourougaa, Rania Bouraoui, Stefanıa Garzoli, Touhami Lanez

Computational Biology and ChemistryVolume 120، (Pt 2)، Pages 1087542025Article Accès ouvert 7

Potential novel HIV-1 reverse transcriptase inhibitors: a modeling and evaluation approach

Malika Mellaoui, Radhia Mazri, Mohamed Mouadh Messaoui, Aicha Kerassa, Mebarka Ouassaf

STUDIES IN HEALTH SCIENCESVolume 5، (4)، Pages e98732024Article Accès ouvert

Synthesis, In‐Silico Evaluation, ADME Analysis, and Molecular Dynamics Simulation of Novel β‐Lactam Derivatives Based on Diclofenac and Sulindac With Anticancer and Antioxidant Activities

Nabeel Abed Abdul-Rida, Ahmed M. Youssef, Elhafnaoui Lanez, Yahia Bekkar, Najim Aboud Al-Masoudi, Bahjat Ali Saeed, Wasfi A. Al‐Masoudi

Chemistry & BiodiversityVolume 22، (12)، Pages e015862025Article Accès ouvert 6

Synthesis, characterization, structural analysis, hirshfeld surface studies, and molecular docking of 1,3,5-Tris(p-bromophenyl)-1,3,5-triazacyclohexane

Mahmoud Chebbah, Elhafnaoui Lanez, Sofiane Bouacida, Hamza Athmani, Mohammed Larbi Benamor, Radia Hafidi, A. Bouchemma

Journal of Molecular StructureVolume 1348، Pages 1433182025Article Accès ouvert 4

Targeting Alzheimer's disease via phytochemicals from Artemisia campestris L.: GC/MS analysis with an integrated computational approach

Nafila Zouaghi, Elhafnaoui Lanez, Mohammed Larbi Benamor, Salah Neghmouche Nacer, Touhami Lanez, Yahia Bekkar, Habiba Haddad, Khairallah Al-Abdallat, Malek Zihlif, Yahya Al-Abdallat et 4 autres

Food BioscienceVolume 75، Pages 1081282025Article Accès ouvert 2

In silico ADMET, toxicological analysis, molecular docking studies and Molecular dynamics simulation of Afzelin with potential antibacterial effects against Staphylococcus aureus

Elhafnaoui Lanez, Touhami Lanez, Nadjiba Zegheb

Turkish computational and theoretical chemistry/Turkish computational and theoretical chemistry :Volume 7، (3)، Pages 10-162023Article Accès ouvert 17

In Vitro Antimicrobial Activity, DFT/ADMET Studies And Molecular Docking of N-Salicylidene-O-Substituted-Aniline as Inhibitors of HERG I and HERG II

Mohamed Yazid Belghit

Journal of Propulsion Technology2024Article Accès ouvert

Investigation on the Potential of Some N-phenylalkanehydrazides as Superoxide Anion Radical Scavengers and Glutathione Peroxidase Binders with ADME Prediction: Comparison with Vitamin C

Hanane Mouada, Touhami Lanez

Current Bioactive CompoundsVolume 21، (4)2024Article Accès fermé 3

Molecular docking studies for the identifications of novel antimicrobial compounds targeting of staphylococcus aureus

Nabila Aoumeur, Salah Belaıdı, Noureddine Tchouar, Mebarka Ouassaf, Touhami Lanez, Samir Chtita

Moroccan Journal of chemistry2020Article Accès ouvert 7

MOLECULAR DOKING AND ADMET STUDIES OF AMINO-PYRIMIDINE DERIVATIES AS MYCOBACTERIUM TUBERCULOSIS SER/THR PROTEIN KINASES B INHIBITORS

Saida Khamoulı, Salah Belaıdı, Touhami Lanez

Journal of Fundamental and Applied SciencesVolume 11، (2)، Pages 914-9392019Article Accès ouvertPlusieurs sources 2

Exploring potential therapeutics: Targeting dengue virus NS5 through molecular docking, ADMET profiling, and DFT analysis

Radhia Mazri, Mebarka Ouassaf, Aicha Kerassa, Bader Y. Alhatlani

Chemical Physics ImpactVolume 8، Pages 1004682024Article Accès ouvert 11

Antidiabetic Potential of Synthesized Ferrocenylmethylaniline Derivatives: Insights From In Vitro Studies, Molecular Docking, ADMET, DFT Calculations, and Molecular Dynamics Simulation

Yahia Bekkar, Elhafnaoui Lanez, Touhami Lanez, Lotfi Bourougaa, Aicha Adaika, Zahra Saada, Aida Benine

Biotechnology and Applied BiochemistryVolume 73، (1)، Pages 198-2112025Article Accès fermé 14

Exploring the Interactions of Ferrocenylmethylnucleobase Derivatives With BSA and HHb: Insights From Electrochemical, Spectroscopic, ADMET, in Silico Docking, and MD Simulations

Mohammed Larbi Benamor, Elhafnaoui Lanez, Yahia Bekkar, Aicha Adaika, Touhami Lanez, Kaouther Nesba, Lazhar Bechki

ChemistrySelectVolume 10، (6)2025Article Accès ouvert 14

Synthesis, Antioxidant, and Antidiabetic Potential of Ferrocenylmethylnucleobase Compounds: In Vitro, In Silico Molecular Docking, DFT Calculation, and Molecular Dynamic Simulations

Aicha Adaika, Yahia Bekkar, Souhir Youmbai, Lotfi Bourougaa, Elhafnaoui Lanez, Mohammed Larbi Ben Amor, Kaouther Nesba, Touhami Lanez, Lazhar Bechki

Applied Organometallic ChemistryVolume 39، (2)2025Article Accès fermé 27