U Neogi, KJ Hill, AT Ambikan, X Heng, TP Quinn… - Pathogens, 2020 - mdpi.com
Coronaviruses (CoVs) are positive-stranded RNA viruses that infect humans and animals. Infection by CoVs such as HCoV-229E,-NL63,-OC43 and-HKU1 leads to the common cold …
The RNA-dependent RNA polymerase (RdRp) is a key enzyme which regulates the viral replication of SARS-CoV-2. Remdesivir (RDV) is clinically used drug which targets RdRp …
Rapid changes in the viral genome allow viruses to evade threats posed by the host immune response or antiviral drugs, and can lead to viral persistence in the host cells. RNA …
Nirmatrelvir is an orally available inhibitor of SARS-CoV-2 main protease (Mpro) and the main ingredient of PAXLOVID, a drug approved by FDA for high-risk COVID-19 patients …
Introduction Despite all the efforts to treat COVID-19, no particular cure has been found for this virus. Since developing antiviral drugs is a time-consuming process, the most effective …
Y Zhao, G He, W Huang - Signal transduction and targeted therapy, 2021 - nature.com
RNA-dependent RNA polymerase (RdRp), also known as nsp12, is a key component in the synthesis of viral ribonucleic acid (RNA) and is considered the primary target of nucleoside …
S Gul, O Ozcan, S Asar, A Okyar, I Barıs… - Journal of …, 2021 - Taylor & Francis
Despite strict measures taken by many countries, severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) continues to be an issue of global concern. Currently, there are …
Z Elkarhat, H Charoute, L Elkhattabi… - Journal of …, 2022 - Taylor & Francis
The SARS-cov-2 RNA dependent RNA polymerase (nsp12) is a crucial viral enzyme that catalyzes the replication of RNA from RNA templates. The fixation of some ligands in the …
We combine molecular dynamics, statistical mechanics, and hybrid quantum mechanics/molecular mechanics simulations to describe mechanistically the severe acute …