T Huynh, H Wang, B Luan - The Journal of Physical Chemistry …, 2020 - ACS Publications
… for the SARS-CoV-2 virus. Irreversible inhibitors like N3 are efficacious and have been proven to inhibit SARS-CoV-2 … Given the urgency, we used in silico methods to explore a set of 19 …
… coronavirus 2 (SARS-CoV-2), with very limited treatments so far. Demonstrated with good druggability, two major proteases of SARS-CoV-2, … Here, we carried out the in silico high-…
K Pandey, KB Lokhande, KV Swamy… - … and Biology Insights, 2021 - journals.sagepub.com
… inhibitory action against SARS-CoV-2 RdRp. In the present study, in silico approach was … from Aegle marmelos and Phyllanthus emblica against SARS-CoV-2 RdRp. The potential of …
… Herein we describe the in silico molecular docking results that intended quickly discovery … silico study focused on identifying drug leads that target main protease (M pro ) of SARS-CoV-2…
… st century, two outbreaks of SARS-CoV and MERS-CoV have led the researchers into designing vaccines against SARS coronaviruses. The third outbreak, wherein SARS-CoV-2 infects …
Y Thakur, R Pande - Chemical Physics, 2021 - Elsevier
In the present investigation, molecular docking studies have been performed using AutoDock Vina to investigate the role of ligand-binding affinity at the hydrophobic pocket of COVID-19…
FB Omage, A Madabeni, AR Tucci… - Journal of Chemical …, 2023 - ACS Publications
… vitro (PhSe) 2 effect against SARS-CoV-2 replication, we sought … silico approach. For this purpose, we thoroughly analyze in silico the structural and chemical mechanism of SARS-CoV-…
… COVID-19 was caused by a novel coronavirus known as SARS-CoV-2. The COVID-19 … several herbal leads was performed to explore their potential against SARS-CoV-2. Furthermore, …
… therapeutic target in combating SARS-CoV-2 pathogenesis. … Other approaches including in silico ADMET analysis, prediction … The current study is based on in silico analysis which was …