Study of novel triazolo-benzodiazepine analogues as antidepressants targeting by molecular docking and ADMET properties prediction

por Belhassan, Assia, Zaki, Hanane, Benlyas, Mohamed, Lakhlifi, Tahar, Bouachrine, Mohammed
Publicado 2019

Molecular docking analysis of N-substituted Oseltamivir derivatives with the SARS-CoV-2 main protease

por Belhassan, Assia, Chtita, Samir, Zaki, Hanane, Lakhlifi, Tahar, Bouachrine, Mohammed
Publicado 2020

Assessment of effective imidazole derivatives against SARS-CoV-2 main protease through computational approach

por Belhassan, Assia, En-nahli, Fatima, Zaki, Hanane, Lakhlifi, Tahar, Bouachrine, Mohammed
Publicado 2020

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

por Belhassan, Assia, Zaki, Hanane, Chtita, Samir, Alaqarbeh, Marwa, Alsakhen, Nada, Benlyas, Mohamed, Lakhlifi, Tahar, Bouachrine, Mohammed
Publicado 2021

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...

por Belhassan, Assia, Chtita, Samir, Zaki, Hanane, Alaqarbeh, Marwa, Alsakhen, Nada, Almohtaseb, Firas, Lakhlifi, Tahar, Bouachrine, Mohammed
Publicado 2022

QSAR study of anti-Human African Trypanosomiasis activity for 2-phenylimidazopyridines derivatives using DFT and Lipinski's descriptors

por Chtita, Samir, Ghamali, Mounir, Ousaa, Abdellah, Aouidate, Adnane, Belhassan, Assia, Taourati, Abdelali Idrissi, Masand, Vijay Hariram, Bouachrine, Mohammed, Lakhlifi, Tahar
Publicado 2019

QSAR study of unsymmetrical aromatic disulfides as potent avian SARS-CoV main protease inhibitors using quantum chemical descriptors and statistical methods

por Chtita, Samir, Belhassan, Assia, Bakhouch, Mohamed, Taourati, Abdelali Idrissi, Aouidate, Adnane, Belaidi, Salah, Moutaabbid, Mohammed, Belaaouad, Said, Bouachrine, Mohammed, Lakhlifi, Tahar
Publicado 2021

QSAR, ADMET In Silico Pharmacokinetics, Molecular Docking and Molecular Dynamics Studies of Novel Bicyclo (Aryl Methyl) Benzamides as Potent GlyT1 Inhibitors for the Treatment of S...

por El fadili, Mohamed, Er-Rajy, Mohammed, Kara, Mohammed, Assouguem, Amine, Belhassan, Assia, Alotaibi, Amal, Mrabti, Nidal Naceiri, Fidan, Hafize, Ullah, Riaz, Ercisli, Sezai, Zarougui, Sara, Elhallaoui, Menana
Publicado 2022

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

por Chtita, Samir, Belaidi, Salah, Qais, Faizan Abul, Ouassaf, Mebarka, AlMogren, Muneerah Mogren, Al-Zahrani, Ateyah A., Bakhouch, Mohamed, Belhassan, Assia, Zaki, Hanane, Bouachrine, Mohammed, Lakhlifi, Tahar
Publicado 2022