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Modeling novel Anti-Viral peptides (AVPs) with in-silico docking simulations against corona virus

The havoc created by Corona virus has been dealt with using various integrative approaches adopted by laboratories through-out the world. Use of anti-viral peptides (AVPs) although new but has shown tremendous potential against many pathogens. Previously AVPs have been designed against spike protein...

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Autores principales: Sharma, Aditi, Pant, Kumud, Pande, Akshara, Sinha, Somya, Pant, Bhasker
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier Ltd. 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7914030/
https://www.ncbi.nlm.nih.gov/pubmed/33680868
http://dx.doi.org/10.1016/j.matpr.2021.02.377
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author Sharma, Aditi
Pant, Kumud
Pande, Akshara
Sinha, Somya
Pant, Bhasker
author_facet Sharma, Aditi
Pant, Kumud
Pande, Akshara
Sinha, Somya
Pant, Bhasker
author_sort Sharma, Aditi
collection PubMed
description The havoc created by Corona virus has been dealt with using various integrative approaches adopted by laboratories through-out the world. Use of anti-viral peptides (AVPs) although new but has shown tremendous potential against many pathogens. Previously AVPs have been designed against spike protein of corona virus which is the major entry mediating molecule. Using various in-silico strategies, in this research work AVPs have been modeled against lesser studied viral proteins namely ORF7a protein, Envelope protein (E), Nucleoprotein (N), and Non-Structural protein (Nsp1 and Nsp2). The predicted AVPs have been docked against various host as well as viral proteins. The interaction of small AVPs seems capable of interfering with binding between viral protein and its host counterpart. Therefore, these AVPs can act as a deterrent against novel corona virus, which requires further validation through laboratory techniques.
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spelling pubmed-79140302021-03-01 Modeling novel Anti-Viral peptides (AVPs) with in-silico docking simulations against corona virus Sharma, Aditi Pant, Kumud Pande, Akshara Sinha, Somya Pant, Bhasker Mater Today Proc Article The havoc created by Corona virus has been dealt with using various integrative approaches adopted by laboratories through-out the world. Use of anti-viral peptides (AVPs) although new but has shown tremendous potential against many pathogens. Previously AVPs have been designed against spike protein of corona virus which is the major entry mediating molecule. Using various in-silico strategies, in this research work AVPs have been modeled against lesser studied viral proteins namely ORF7a protein, Envelope protein (E), Nucleoprotein (N), and Non-Structural protein (Nsp1 and Nsp2). The predicted AVPs have been docked against various host as well as viral proteins. The interaction of small AVPs seems capable of interfering with binding between viral protein and its host counterpart. Therefore, these AVPs can act as a deterrent against novel corona virus, which requires further validation through laboratory techniques. Elsevier Ltd. 2021 2021-02-27 /pmc/articles/PMC7914030/ /pubmed/33680868 http://dx.doi.org/10.1016/j.matpr.2021.02.377 Text en © 2021 Elsevier Ltd. All rights reserved. Selection and peer-review under responsibility of the scientific committee of the International Conference on Technological Advancements in Materials Science and Manufacturing. Since January 2020 Elsevier has created a COVID-19 resource centre with free information in English and Mandarin on the novel coronavirus COVID-19. The COVID-19 resource centre is hosted on Elsevier Connect, the company's public news and information website. Elsevier hereby grants permission to make all its COVID-19-related research that is available on the COVID-19 resource centre - including this research content - immediately available in PubMed Central and other publicly funded repositories, such as the WHO COVID database with rights for unrestricted research re-use and analyses in any form or by any means with acknowledgement of the original source. These permissions are granted for free by Elsevier for as long as the COVID-19 resource centre remains active.
spellingShingle Article
Sharma, Aditi
Pant, Kumud
Pande, Akshara
Sinha, Somya
Pant, Bhasker
Modeling novel Anti-Viral peptides (AVPs) with in-silico docking simulations against corona virus
title Modeling novel Anti-Viral peptides (AVPs) with in-silico docking simulations against corona virus
title_full Modeling novel Anti-Viral peptides (AVPs) with in-silico docking simulations against corona virus
title_fullStr Modeling novel Anti-Viral peptides (AVPs) with in-silico docking simulations against corona virus
title_full_unstemmed Modeling novel Anti-Viral peptides (AVPs) with in-silico docking simulations against corona virus
title_short Modeling novel Anti-Viral peptides (AVPs) with in-silico docking simulations against corona virus
title_sort modeling novel anti-viral peptides (avps) with in-silico docking simulations against corona virus
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7914030/
https://www.ncbi.nlm.nih.gov/pubmed/33680868
http://dx.doi.org/10.1016/j.matpr.2021.02.377
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