Hanane Zaki

In silico detection of potential inhibitors from vitamins and their derivatives compounds against SARS-CoV-2 main protease by using molecular docking, molecular dynamic simulation and ADMET profiling

Assia Belhassan, Samir Chtita, Hanane Zaki et al. · Journal of Molecular Structure · 2022 · 70 citations · Full text

Pharmacy, Medicinal Chemistry, Pharmacology +17

Camphor, Artemisinin and Sumac Phytochemicals as inhibitors against COVID-19: Computational approach

Assia Belhassan, Hanane Zaki, Samir Chtita et al. · Computers in Biology and Medicine · 2021 · 60 citations · Full text

Pharmacy, Medicinal Chemistry, Pharmacology +13

Unsymmetrical aromatic disulfides as SARS-CoV-2 Mpro inhibitors: Molecular docking, molecular dynamics, and ADME scoring investigations

Samir Chtita, Faizan Abul Qais, Mebarka Ouassaf et al. · Journal of King Saud University - Science · 2022 · 49 citations · Full text

Pharmacy, Medicinal Chemistry, Pharmacology +14

The anticoagulant potential of Lippia Alba extract in inhibiting SARS-CoV-2 Mpro: Density functional calculation, molecular docking analysis, and molecular dynamics simulations

Imane Yamari, Oussama Abchır, Farhan Siddique et al. · Scientific African · 2023 · 25 citations · Full text

Pharmacy, Medicinal Chemistry, Pharmacology +16

Molecular docking of potential cytotoxic alkylating carmustine derivatives 2-chloroethylnitrososulfamides analogues of 2-chloroethylnitrosoureas

Wafa Soudani, Fatima Zohra Hadjadj-Aoul, Mohammed Bouachrıne et al. · Journal of Biomolecular Structure and Dynamics · 2020 · 22 citations

Pharmacy, Chemistry, Pharmacology +17