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On irregularity integral Sombor indices: theory and chemical applications

  • Ricardo Abreu-Blaya,
  • Jorge Batanero,
  • José M. Rodríguez,
  • José M. Sigarreta

摘要

Let \(G=(V(G),E(G))\) G = ( V ( G ) , E ( G ) ) be a simple graph and denote by \(d_{u}\) d u the degree of the vertex \(u\in V(G)\) u V ( G ) . Using a geometric approach, Gutman introduced a new vertex-degree-based topological index, defined as \(\begin{aligned} SO(G)=\sum _{uv\in E(G)}\sqrt{(d_{u})^{2}+(d_{v})^{2}}, \end{aligned}\) S O ( G ) = u v E ( G ) ( d u ) 2 + ( d v ) 2 , and named Sombor index. It is a molecular descriptor with an impressive research activity in recent years. In this paper we propose and initiate the study of a family of topological indices, also conceived from a geometric point of view, called irregularity integral Sombor indices, that generalize the Sombor index. Also, we study the application of these indices in QSPR/QSAR research.