Potential novel HIV-1 reverse transcriptase inhibitors: a modeling and evaluation approachMalika Mellaoui, Radhia Mazri, Mohamed Mouadh Messaoui, Aicha Kerassa, Mebarka OuassafSTUDIES IN HEALTH SCIENCESVolume 5، (4)، Pages e98732024Article Accès ouvert
Novel therapeutic agents for H5N1 influenza virus through 3D-QSAR, molecular docking, ADMET prediction, and DFT based global reactivity descriptorsAfaf Zekri, Mebarka Ouassaf, Shafi Ullah Khan, Aicha Kerassa, Bader Y. AlhatlaniJournal of the Indian Chemical SocietyVolume 101، (11)، Pages 1013732024Article Accès fermé 4
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 InvestigationsNour-El Houda Derki, Aicha Kerassa, Salah Belaıdı, Maroua Derki, Imane Yamari, Abdelouahid Samadi, Samir ChtitaMoleculesVolume 29، (4)، Pages 8222024Article Accès ouvert 7
Study by computational methods of the electronic structure of a series of organic molecules and their charge transfer complexesSalah Belaıdı, Aicha Kerassa2024Prépublication Accès ouvert
Exploring potential therapeutics: Targeting dengue virus NS5 through molecular docking, ADMET profiling, and DFT analysisRadhia Mazri, Mebarka Ouassaf, Aicha Kerassa, Bader Y. AlhatlaniChemical Physics ImpactVolume 8، Pages 1004682024Article Accès ouvert 11
Corrosion Inhibition of Azo Compounds Derived from Schiff Bases on Mild Steel (XC70) in (HCl, 1 M DMSO) Medium: An Experimental and Theoretical StudyAmmar Zobeidi, Salah Neghmouche Nacer, Salem Atia, Latifa Kribaa, Aicha Kerassa, Abasse Kamarchou, Mousa Z. Al-Noaimi, Djamel Ghernaout, Mohamed A. Ali, Abdelmajeed Adam Lagum et 1 autresACS OmegaVolume 8، (24)، Pages 21571-215842023Article Accès ouvert 25
Experimental and quantum chemical studies on molecular structure, spectroscopic analysis, NLO analysis and HOMO-LUMO of substituted N-ferrocenylmethyl-N-phenylamidesNadjiba Zegheb, C. Boubékri, Touhami Lanez, Aicha KerassaJournal of Fundamental and Applied SciencesVolume 13، (1)، Pages 264-2912021Article Accès ouvertPlusieurs sources 3
Conformational analysis and QSAR modeling of 14-membered macrolide analogues against mycobacterium tuberculosisK. Zitouni, Salah Belaıdı, Aicha KerassaJournal of Fundamental and Applied SciencesVolume 12، (3)، Pages 1035-10662020Article Accès ouvert 2