Molecular Docking and Dynamics Simulation Study of Hyrtios erectus Isolated Scalarane Sesterterpenes as Potential SARS-CoV-2 Dual Target Inhibitors
Simple Summary The ongoing coronavirus disease-2019 (COVID-19) pandemic shows
unprecedented challenges for the worldwide healthcare system. Despite the large clinical …
unprecedented challenges for the worldwide healthcare system. Despite the large clinical …
Protease inhibitory effect of natural polyphenolic compounds on SARS-CoV-2: an in silico study
The current pandemic, caused by SARS-CoV-2 virus, is a severe challenge for human
health and the world economy. There is an urgent need for development of drugs that can …
health and the world economy. There is an urgent need for development of drugs that can …
In silico Screening of Natural Compounds as Potential Inhibitors of SARS-CoV-2 Main Protease and Spike RBD: Targets for COVID-19
Historically, plants have been sought after as bio-factories for the production of diverse
chemical compounds that offer a multitude of possibilities to cure diseases. To combat the …
chemical compounds that offer a multitude of possibilities to cure diseases. To combat the …
Potential bioactive glycosylated flavonoids as SARS-CoV-2 main protease inhibitors: A molecular docking and simulation studies
SA Cherrak, H Merzouk, N Mokhtari-Soulimane - Plos one, 2020 - journals.plos.org
A novel coronavirus responsible of acute respiratory infection closely related to SARS-CoV
has recently emerged. So far there is no consensus for drug treatment to stop the spread of …
has recently emerged. So far there is no consensus for drug treatment to stop the spread of …
In silico evaluation of different flavonoids from medicinal plants for their potency against SARS-CoV-2
The ongoing pandemic situation of COVID-19 caused by severe acute respiratory syndrome
coronavirus 2 (SARS-CoV-2) poses a global threat to both the world economy and public …
coronavirus 2 (SARS-CoV-2) poses a global threat to both the world economy and public …
In silico identification of new anti-SARS-CoV-2 agents from bioactive phytocompounds targeting the viral spike glycoprotein and human TLR4
Background: The recent outbreak of novel coronavirus disease (COVID-19) pandemic
caused by SARS-CoV-2 has posed a tremendous threat to mankind. The unavailability of a …
caused by SARS-CoV-2 has posed a tremendous threat to mankind. The unavailability of a …
DFT, molecular docking and molecular dynamics simulation studies on some newly introduced natural products for their potential use against SARS-CoV-2
T Erdogan - Journal of Molecular Structure, 2021 - Elsevier
Throughout the history, natural products always give new paths to develop new drugs. As
with many other diseases, natural compounds can be helpful in the treatment of COVID-19 …
with many other diseases, natural compounds can be helpful in the treatment of COVID-19 …
Insights into the inhibitory potential of selective phytochemicals against Mpro of 2019-nCoV: a computer-aided study
At the end of December 2019, a novel strain of coronavirus, given the name of 2019-nCoV,
emerged for exhibiting symptoms of severe acute respiratory syndrome. The virus is …
emerged for exhibiting symptoms of severe acute respiratory syndrome. The virus is …
Identification of 1H-purine-2, 6-dione derivative as a potential SARS-CoV-2 main protease inhibitor: molecular docking, dynamic simulations, and energy calculations
The rapid spread of the coronavirus since its first appearance in 2019 has taken the world by
surprise, challenging the global economy, and putting pressure on healthcare systems …
surprise, challenging the global economy, and putting pressure on healthcare systems …
Evaluation of medicinal herbs as a potential therapeutic option against SARS‐CoV‐2 targeting its main protease
S Upadhyay, PK Tripathi, M Singh… - Phytotherapy …, 2020 - Wiley Online Library
The COVID‐19 disease caused by the SARS‐CoV‐2 has emerged as a worldwide
pandemic and caused huge damage to the lives and economy of more than hundred …
pandemic and caused huge damage to the lives and economy of more than hundred …