Nadjib Melkemi

Combined QSAR, molecular docking and molecular dynamics study on new Acetylcholinesterase and Butyrylcholinesterase inhibitors

Ismail Daoud, Nadjib Melkemi, Toufik Salah et al. · Computational Biology and Chemistry · 2018 · 96 citations

Molecular Docking, Medicinal Chemistry, Drug Target +10

Discovery of potential SARS-CoV 3CL protease inhibitors from approved antiviral drugs using: virtual screening, molecular docking, pharmacophore mapping evaluation and dynamics simulation

Ismail Daoud, Fouzia Mesli, Nadjib Melkemi et al. · Journal of Biomolecular Structure and Dynamics · 2021 · 24 citations · Full text

K-means clustering analysis, ADME/pharmacokinetic prediction, MEP, and molecular docking studies of potential cytotoxic agents

Ahlem Belkadi, Samir Kenouche, Nadjib Melkemi et al. · Structural Chemistry · 2021 · 22 citations

Medicinal Chemistry, Potential Cytotoxic Agents, Medicine +9

High regioselectivity in the amination reaction of isoquinolinequinone derivatives using conceptual DFT and NCI analysis

Samir Kenouche, Ahlem Belkadi, R. Djebaïli et al. · Journal of Molecular Graphics and Modelling · 2020 · 18 citations

Derivative (Chemistry), High Regioselectivity, Conceptual Dft +8

DFT-based reactivity and combined QSAR, molecular docking of 1,2,4,5-Tetrazine derivatives as inhibitors of Pim-1 kinase

Halima Hazhazi, Nadjib Melkemi, Toufik Salah et al. · Heliyon · 2019 · 15 citations · Full text

Medicinal Chemistry, Pim-1 Kinase, Chemical Analysis +15