Lotfi Bourougaa

Molecular docking, ADME-Tox, DFT and molecular dynamics simulation of butyroyl glucopyranoside derivatives against DNA gyrase inhibitors as antimicrobial agents

Nasrin Akter, Lotfi Bourougaa, Mebarka Ouassaf et al. · Journal of Molecular Structure · 2024 · 50 citations

Molecular Docking, Medicinal Chemistry, Drug Analysis +11

Identification of Potent Acetylcholinesterase Inhibitors as New Candidates for Alzheimer Disease via Virtual Screening, Molecular Docking, Dynamic Simulation, and Molecular Mechanics–Poisson–Boltzmann Surface Area Calculations

Hind Yassmine Chennai, Lotfi Bourougaa, Mebarka Ouassaf et al. · Molecules · 2024 · 25 citations · Full text

Marine-Derived Compounds as Potential Inhibitors of Hsp90 for Anticancer and Antimicrobial Drug Development: A Comprehensive In Silico Study

Mebarka Ouassaf, Lotfi Bourougaa, Samiah H. Al-Mijalli et al. · Molecules · 2023 · 23 citations · Full text

Computational-based investigation of antioxidative potential polyphenolic compounds of Salvia officinalis L.: combined DFT and molecular docking approaches

Ridha Bendaas, Yahia Bekkar, L. Messaadia et al. · Journal of Molecular Modeling · 2024 · 20 citations

Polyphenolics, Computational-based Investigation, Biochemistry +7

Pharmacoinformatics and Breed-Based De Novo Hybridization Studies to Develop New Neuraminidase Inhibitors as Potential Anti-Influenza Agents

Lotfi Bourougaa, Mebarka Ouassaf, Bader Y. Alhatlani et al. · Molecules · 2023 · 15 citations · Full text

New Neuraminidase Inhibitors, Ligand Frameworks, Potential Anti-influenza Agents +13