Graph Theoretical Analysis of SARS-COV-2 Spike Protein

The spike protein of the severe acute respiratory syndrome coronavirus-2 (SARS-CoV-2) is the main surface antigen of the coronavirus. The global pandemic that affected most countries and territories in 2019 was caused by the emergence of the SARS-CoV-2 spike protein. Graph theoretical analysis plays an important role in biological networks. First, we construct the Pt-graph of SARS-CoV-2 based on the physicochemical properties and adjacency of amino acids in the corresponding peptide/protein in SARS-CoV-2. By analyzing the of Pt-graph, we receive some observations about the relations among the amino acids, physiochemical properties of amino acids and peptide/protein, and it will help in the development of and drug design. In this study, we analyze the Pt-graph of the SARS-CoV-2 spike protein to examine its structural properties.

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Publication Details

Journal
International Journal of Basic and Applied Sciences
Published
2025-08-08
DOI
https://doi.org/10.14419/01r2zb80
Primary Topic
Computational Drug Discovery Methods
Type
article
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article

Graph Theoretical Analysis of SARS-COV-2 Spike Protein

Marcelo Fuentes V., T B Athul, Roy M. John, C. K. Akhil et al.
International Journal of Basic and Applied Sciences
Computational Drug Discovery Methods
article

Graph Theoretical Analysis of SARS-COV-2 Spike Protein

Marcelo Fuentes V., T B Athul, Roy M. John, C. K. Akhil, A B Subha
article en

Abstract

The spike protein of the severe acute respiratory syndrome coronavirus-2 (SARS-CoV-2) is the main surface antigen of the coronavirus. The global pandemic that affected most countries and territories in 2019 was caused by the emergence of the SARS-CoV-2 spike protein. Graph theoretical analysis plays an important role in biological networks. First, we construct the Pt-graph of SARS-CoV-2 based on the physicochemical properties and adjacency of amino acids in the corresponding peptide/protein in SARS-CoV-2. By analyzing the of Pt-graph, we receive some observations about the relations among the amino acids, physiochemical properties of amino acids and peptide/protein, and it will help in the development of and drug design. In this study, we analyze the Pt-graph of the SARS-CoV-2 spike protein to examine its structural properties.

International Journal of Basic and Applied SciencesVol. 14(4)
University of Kerala (IN), Government of Kerala (IN), Narayana Health (IN), Stephens College (US)
Openalex Percentile: Top 78%
Computational Drug Discovery Methods
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Graph Theoretical Analysis of SARS-COV-2 Spike Protein — Marcelo Fuentes V., T B Athul, et al. · International Journal of Basic and Applied Sciences (2025) | TGRS Research Map | TGRS