Publications by authors named "Adib Ghaleb"

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Supervised machine learning and molecular docking modeling to identify potential Anti-Parkinson's agents.
Adib Ghaleb, Adnane Aouidate, Mohammed Aarjane, Hafid Anane

J Mol Graph Model· September 2025

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Synthesis and Evaluation of Antimicrobial Activity of the Rearranged Abietane Prattinin A and Its Synthetic Derivatives.
Mustapha Ait El Had, Manal Zefzoufi, Houda Zentar, Lahoucine Bahsis, Mouhi Eddine Hachim, Adib Ghaleb

Molecules· January 2024

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Chemical Profiling and Biological Properties of Essential Oils of L. Collected from Three Moroccan Sites: In Vitro and In Silico Investigations.
Taoufiq Benali, Ahmed Lemhadri, Kaoutar Harboul, Houda Chtibi, Abdelmajid Khabbach, Adib Ghaleb

Plants (Basel)· March 2023

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Design, synthesis, DFT calculations, molecular docking and antimicrobial activities of novel cobalt, chromium metal complexes of heterocyclic moiety-based 1,3,4-oxadiazole derivatives.
Taoufik Rohand, Hicham Ben El Ayouchia, Hafid Achtak, Adib Ghaleb, Yavuz Derin

J Biomol Struct Dyn· December 2022

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In silico molecular investigations of pyridine N-Oxide compounds as potential inhibitors of SARS-CoV-2: 3D QSAR, molecular docking modeling, and ADMET screening.
Adib Ghaleb, Adnane Aouidate, Hicham Ben El Ayouchia, Mohammed Aarjane, Hafid Anane

J Biomol Struct Dyn· January 2022

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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.
Adnane Aouidate, Adib Ghaleb, Samir Chtita, Mohammed Aarjane, Abdellah Ousaa

J Biomol Struct Dyn· August 2021

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In Silico Exploration of Aryl Halides Analogues as Checkpoint Kinase 1 Inhibitors by Using 3D QSAR, Molecular Docking Study, and ADMET Screening.
Adib Ghaleb, Adnane Aouidate, Mohammed Bouachrine, Tahar Lakhlifi, Abdelouhid Sbai

Adv Pharm Bull· February 2019

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3D QSAR studies, molecular docking and ADMET evaluation, using thiazolidine derivatives as template to obtain new inhibitors of PIM1 kinase.
Adnane Aouidate, Adib Ghaleb, Mounir Ghamali, Abdellah Ousaa, M'barek Choukrad

Comput Biol Chem· June 2018

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QSAR study and rustic ligand-based virtual screening in a search for aminooxadiazole derivatives as PIM1 inhibitors.
Adnane Aouidate, Adib Ghaleb, Mounir Ghamali, Samir Chtita, Abdellah Ousaa

Chem Cent J· March 2018

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Computer aided drug design based on 3D-QSAR and molecular docking studies of 5-(1H-indol-5-yl)-1,3,4-thiadiazol-2-amine derivatives as PIM2 inhibitors: a proposal to chemists.
Adnane Aouidate, Adib Ghaleb, Mounir Ghamali, Samir Chtita, Abdellah Ousaa

In Silico Pharmacol· March 2018

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QSAR studies on PIM1 and PIM2 inhibitors using statistical methods: a rustic strategy to screen for 5-(1H-indol-5-yl)-1,3,4-thiadiazol analogues and predict their PIM inhibitory activity.
Adnane Aouidate, Adib Ghaleb, Mounir Ghamali, Samir Chtita, M'barek Choukrad

Chem Cent J· May 2017

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