Keywords = 3D-QSAR
Number of Articles: 7
In Silico Approach for Developing New Anti-Tuberculosis Drug Candidates: 3D-QSAR, Molecular Docking and ADME Studies of Pretomanid Derivatives

Volume 12, Issue 3, September 2024, Pages 729-743

Abderahmane Belafriekh; Aicha Laoud; Larbi Elmchichi; Mohammed Bouachrine

In Silico Approach for Developing New Anti-Tuberculosis Drug Candidates: 3D-QSAR, Molecular Docking and ADME Studies of Pretomanid Derivatives

3D QSAR, Molecular Docking, and ADMET Studies of a Series of 2-Acetylphenol-Rivastigmine Hybrids against Monoamine Oxidase A Inhibitors

Volume 12, Issue 1, March 2024, Pages 249-262

Lhoucine Naanaai; Abdellah El Aissouq; Hicham Zaitan; Fouad Khalil

3D QSAR, Molecular Docking, and ADMET Studies of a Series of 2-Acetylphenol-Rivastigmine Hybrids against Monoamine Oxidase A Inhibitors

Novel Styrylquinoline Derivatives as Potential Anticancer Agents, In-Silico studies by 3D-QSAR, Molecular Docking, and Molecular Dynamics Simulations

Volume 11, Issue 4, December 2023, Pages 953-967

Amina Goudzal; Abdellah El Aissouq; HADAJI El ghalia; el hamdani hicham; Cheddadi Oussama; Abdelkrim Ouammou; Mohammed Bouachrine

Novel Styrylquinoline Derivatives as Potential Anticancer Agents, In-Silico studies by 3D-QSAR, Molecular Docking, and Molecular Dynamics Simulations

Discovery of New Inhibitors of Enoyl-ACP Reductase via Structure-Based Virtual Screening

Volume 11, Issue 3, September 2023, Pages 459-469

Aicha Laoud; Fahima Alirachedi; Fouad Ferkous

Discovery of New Inhibitors of Enoyl-ACP Reductase via Structure-Based Virtual Screening

Prediction of Novel TRPV1 Antagonist: A Combination of 3D-QSAR, Molecular Docking, MD Simulations and ADMET Prediction

Volume 11, Issue 2, June 2023, Pages 353-368

Toughzaoui Abdelilah; Chedadi Oussama; Abdellah El Aissouq; El Ouardi Youssef; Mohammed Bouachrine; Abdelkrim Ouammou

Prediction of Novel TRPV1 Antagonist: A Combination of 3D-QSAR, Molecular Docking, MD Simulations and ADMET Prediction

Identification of a Potential Thiazole Inhibitor Against Biofilms by 3D QSAR, Molecular Docking, DFT Analysis, MM-PBSA Binding Energy Calculations, and Molecular Dynamics Simulation

Volume 11, Issue 2, June 2023, Pages 369-389

Kamal Tabti; Halima Hajji; Abdelouahid Sbai; Hamid Maghat; Mohammed Bouachrine; Tahar Lakhlifi

Identification of a Potential Thiazole Inhibitor Against Biofilms by 3D QSAR, Molecular Docking, DFT Analysis, MM-PBSA Binding Energy Calculations, and Molecular Dynamics Simulation

In Silico Prediction of Novel (TRIM24) Bromodomain Inhibitors: A Combination of 3D-QSAR, Molecular Docking, ADMET Prediction, and Molecular Dynamics Simulation

Volume 10, Issue 4, December 2022, Pages 519-535

Chedadi Oussama; EL Aissouq Abbdellah; El Ouardi Youssef; Mohammed Bouachrine; Abdelkrim Ouammou

In Silico Prediction of Novel (TRIM24) Bromodomain Inhibitors: A Combination of 3D-QSAR, Molecular Docking, ADMET Prediction, and Molecular Dynamics Simulation

Physical Chemistry Research

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