Finding potent inhibitors for COVID-19 main protease (Mpro): an in silico approach using SARS-CoV-3CL protease inhibitors for combating CORONA

M Motiwale, NS Yadav, S Kumar… - Journal of …, 2022 - Taylor & Francis
SARS-CoV-2 is liable for the worldwide coronavirus disease (COVID-19) exigency. This
pandemic created the need for all viable treatment strategies available in the market. In this …

In-silico drug repurposing and molecular dynamics puzzled out potential SARS-CoV-2 main protease inhibitors

MAA Ibrahim, AHM Abdelrahman… - Journal of biomolecular …, 2021 - Taylor & Francis
Herein, the DrugBank database which contains 10,036 approved and investigational drugs
was explored deeply for potential drugs that target SARS-CoV-2 main protease (Mpro) …

Anti-HIV and anti-HCV small molecule protease inhibitors in-silico repurposing against SARS-CoV-2 Mpro for the treatment of COVID-19

A Sultan, R Ali, R Ishrat, S Ali - Journal of Biomolecular Structure …, 2022 - Taylor & Francis
The COVID-19 pandemic is caused by severe acute respiratory syndrome coronavirus 2
(SARS-CoV-2). It is a global health emergency warranting development and implementation …

In-silico drug repurposing for targeting SARS-CoV-2 main protease (Mpro)

S Sharma, S Deep - Journal of Biomolecular Structure and …, 2022 - Taylor & Francis
COVID-19, caused by novel coronavirus or SARS-CoV-2, is a viral disease which has
infected millions worldwide. Considering the urgent need of the drug for fighting against this …

Synthetic flavonoids as potential antiviral agents against SARS-CoV-2 main protease

F Batool, EU Mughal, K Zia, A Sadiq… - Journal of …, 2022 - Taylor & Francis
The COVID-19 pandemic has claimed more than a million lives worldwide within a short
time span. Due to the unavailability of specific antiviral drugs or vaccine, the infections are …

[HTML][HTML] In silico identification and docking-based drug repurposing against the main protease of SARS-CoV-2, causative agent of COVID-19

Y Kumar, H Singh - 2020 - europepmc.org
The rapidly enlarging COVID-19 pandemic caused by novel SARS-coronavirus 2 is a global
public health emergency of unprecedented level. Therefore the need of a drug or vaccine …

Targeting two potential sites of SARS-CoV-2 main protease through computational drug repurposing

A Prakash, S Borkotoky, VK Dubey - Journal of Biomolecular …, 2023 - Taylor & Francis
Before the rise of SARS-CoV-2, emergence of different coronaviruses such as SARS-CoV
and MERS-CoV has been reported that indicates possibility of the future novel pathogen …

[PDF][PDF] Identification of Drug Combination Therapies for SARS-CoV-2: A Molecular Dynamics Simulations Approach

H Abdel-Halim, M Hajar, L Hasouneh… - Drug Design …, 2022 - Taylor & Francis
Purpose The development of effective treatments for coronavirus infectious disease 19
(COVID-19) caused by SARS-Coronavirus-2 was hindered by the little data available about …

Determination of potential inhibitors based on isatin derivatives against SARS-CoV-2 main protease (mpro): a molecular docking, molecular dynamics and structure …

VN Badavath, A Kumar, PK Samanta… - Journal of …, 2022 - Taylor & Francis
Abstract SARS-COV-2, the novel coronavirus and root of global pandemic COVID-19
caused a severe health threat throughout the world. Lack of specific treatments raised an …

Drug Repurposing for Candidate SARS-CoV-2 Main Protease Inhibitors by a Novel In Silico Method

M Sencanski, V Perovic, SB Pajovic, M Adzic… - Molecules, 2020 - mdpi.com
The SARS-CoV-2 outbreak caused an unprecedented global public health threat, having a
high transmission rate with currently no drugs or vaccines approved. An alternative powerful …