Dalal Harkati

Molecular docking, molecular dynamics simulations and reactivity, studies on approved drugs library targeting ACE2 and SARS-CoV-2 binding with ACE2

Hadjer Khelfaoui, Dalal Harkati, Basil A. Saleh · Journal of Biomolecular Structure and Dynamics · 2020 · 93 citations · Full text

QSAR modeling, docking, ADME and reactivity of indazole derivatives as antagonizes of estrogen receptor alpha (ER-α) positive in breast cancer

Afaf Zekri, Dalal Harkati, Samir Kenouche et al. · Journal of Molecular Structure · 2020 · 30 citations

Molecular Pharmacology, Medicinal Chemistry, Breast Oncology +13

Investigations on Molecular Structure, Electronic Properties, NLO Properties and Comparison of Drug-Likeness of Triazolothiadiazole Derivatives by Quantum Methods and QSAR Analysis

Aicha Kerassa, Dalal Harkati, Touhami Lanez et al. · Reviews in Theoretical Science · 2016 · 20 citations

Combinatorial Chemistry, Derivative (Chemistry), Engineering +10

Carbazole derivatives containing chalcone analogues targeting topoisomerase II inhibition: First principles characterization and QSAR modelling

Meriam Ghamri, Dalal Harkati, Samia Boudergua et al. · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2020 · 15 citations

Combinatorial Chemistry, Medicinal Chemistry, Biochemistry +10

In Silico Pesticide Discovery for New Anti-Tobacco Mosaic Virus Agents: Reactivity, Molecular Docking, and Molecular Dynamics Simulations

Hala A. Abdulhassan, Basil A. Saleh, Dalal Harkati et al. · Applied Sciences · 2022 · 12 citations · Full text