[HTML][HTML] In silico evaluation of flavonoids as effective antiviral agents on the spike glycoprotein of SARS-CoV-2

AS Jain, P Sushma, C Dharmashekar… - Saudi Journal of …, 2021 - Elsevier
silico approach is carried out as a means of inhibiting the spike protein of the novel coronavirus
… that are docked with the spike protein of SARS-CoV-2, to determine the highest binding …

An in-silico evaluation of different Saikosaponins for their potency against SARS-CoV-2 using NSP15 and fusion spike glycoprotein as targets

SK Sinha, A Shakya, SK Prasad, S Singh… - Journal of …, 2021 - Taylor & Francis
… towards SARS-CoV-2. Therefore, in the current investigation attempt has been made to …
and evaluate the potency of different Saikosaponins against different sets of SARS-CoV-2 …

[HTML][HTML] In silico evaluation of different flavonoids from medicinal plants for their potency against SARS-CoV-2

HRA El-Mageed, DA Abdelrheem, MO Rafi, MT Sarker… - Biologics, 2021 - mdpi.com
… of SARS-CoV-2 spike protein into the lung tissue [5,6]. Many studies have revealed the crystal
structures of the main protease of SARS CoV-… To design novel drugs against SARS CoV-2, …

[HTML][HTML] In-silico evaluation of bioactive compounds from tea as potential SARS-CoV-2 nonstructural protein 16 inhibitors

R Singh, VK Bhardwaj, J Sharma, R Purohit… - Journal of traditional and …, 2022 - Elsevier
… novel coronavirus, called the severe acute respiratory syndrome coronavirus 2 (SARS-CoV-…
The nonstructural protein 16 (NSP16) of SARS-CoV-2 plays a significant part in the …

[HTML][HTML] In silico evaluation of the effectivity of approved protease inhibitors against the main protease of the novel SARS-CoV-2 virus

P Eleftheriou, D Amanatidou, A Petrou, A Geronikaki - Molecules, 2020 - mdpi.com
… for the treatment of SARS-CoV-2 [5,6]. Both drugs were proposed as promising agents for
the treatment of SARS-CoV-1 by an in silico study conducted in 2016 which had evaluated the …

[HTML][HTML] Deepening of in silico evaluation of SARS-CoV-2 detection RT-qPCR assays in the context of new variants

M Gand, K Vanneste, I Thomas, S Van Gucht, A Capron… - Genes, 2021 - mdpi.com
… study, this was performed in silico for 11 primers and probe sets using the bioinformatics
tool SCREENED and 84,305 representative SARS-CoV-2 genomes obtained from GISAID and …

[HTML][HTML] In silico evaluation of prospective anti-COVID-19 drug candidates as potential SARS-CoV-2 main protease inhibitors

MAA Ibrahim, AHM Abdelrahman, KS Allemailem… - The Protein …, 2021 - Springer
… human infectious coronavirus that … silico drug discovery tools were utilized to evaluate
the binding affinities and features of eighteen anti-COVID-19 drug candidates against SARS-CoV-…

An in-silico evaluation of dietary components for structural inhibition of SARS-Cov-2 main protease

AK Pandey, S Verma - Journal of Biomolecular Structure and …, 2022 - Taylor & Francis
… Our in-silico analysis proved that natural antioxidants like sesamin, ellagic acid, epicatechin
… most vital active site residue Cys145 of SARS-CoV-2 main protease with great significance …

[HTML][HTML] In silico evaluation of Iranian medicinal plant phytoconstituents as inhibitors against main protease and the receptor-binding domain of SARS-CoV-2

SS Mousavi, A Karami, TM Haghighi, SG Tumilaar… - Molecules, 2021 - mdpi.com
… of the SARS-CoV-2 M pro and RBD receptors. The synthesis of these molecules and evaluation
of their in vitro and in vivo activity against SARS-CoV-2 is worthy of further clinical study. …

[HTML][HTML] In silico evaluation of the interaction between ACE2 and SARS-CoV-2 Spike protein in a hyperglycemic environment

G Sartore, D Bassani, E Ragazzi, P Traldi, A Lapolla… - Scientific Reports, 2021 - nature.com
… , already documented 51,52 , have not been considered in the present study, and may
deserve a future specific in silico evaluation followed by a possible experimental validation. …