Novel dynamic residue network analysis approaches to study allosteric modulation: SARS-CoV-2 M(pro) and its evolutionary mutations as a case study

The rational search for allosteric modulators and the allosteric mechanisms of these modulators in the presence of mutations is a relatively unexplored field. Here, we established novel in silico approaches and applied them to SARS-CoV-2 main protease (M(pro)) as a case study. First, we identified s...

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Detalles Bibliográficos
Autores principales: Sheik Amamuddy, Olivier, Afriyie Boateng, Rita, Barozi, Victor, Wavinya Nyamai, Dorothy, Tastan Bishop, Özlem
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Research Network of Computational and Structural Biotechnology 2021
Materias:
Research Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8613987/
https://www.ncbi.nlm.nih.gov/pubmed/34849191
http://dx.doi.org/10.1016/j.csbj.2021.11.016

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8613987/
https://www.ncbi.nlm.nih.gov/pubmed/34849191
http://dx.doi.org/10.1016/j.csbj.2021.11.016

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