计算类塞格多项式的广义切割法及其在多苯基和碳纳米锥上的应用

IF 2.9 2区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Match-Communications in Mathematical and in Computer Chemistry Pub Date : 2023-04-01 DOI:10.46793/match.90-2.401b
S. Brezovnik, Niko Tratnik
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引用次数: 0

摘要

塞格德、Padmakar-Ivan (PI)和Mostar指数是研究最多的基于距离的塞格德类拓扑指数。另一方面,还介绍了与这些拓扑指标相关的多项式,如seeged多项式、edgeSzeged多项式、PI多项式、Mostar多项式等。本文引入了连通强度加权图的一般类塞格德多项式的概念。事实证明,这个概念包括上述所有的多项式,也包括无数其他的图多项式。作为本文的主要成果,我们证明了一种切法,它使我们能够利用强度加权商图的相应多项式有效地计算类塞格德多项式,该多项式是由比Θ * -划分更粗糙的边集划分得到的。据我们所知,这是第一次实现著名的切法来画多项式。最后,我们展示了如何将推导的切割方法应用于计算对聚苯链和碳纳米锥的一些类塞格德多项式和相应的拓扑指数。
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Generalized Cut Method for Computing Szeged–Like Polynomials with Applications to Polyphenyls and Carbon Nanocones
Szeged, Padmakar-Ivan (PI), and Mostar indices are some of the most investigated distance-based Szeged-like topological indices. On the other hand, the polynomials related to these topological indices were also introduced, for example the Szeged polynomial, the edgeSzeged polynomial, the PI polynomial, the Mostar polynomial, etc. In this paper, we introduce a concept of the general Szeged-like polynomial for a connected strength-weighted graph. It turns out that this concept includes all the above mentioned polynomials and also infinitely many other graph polynomials. As the main result of the paper, we prove a cut method which enables us to efficiently calculate a Szeged-like polynomial by using the corresponding polynomials of strength-weighted quotient graphs obtained by a partition of the edge set that is coarser than Θ∗ -partition. To the best of our knowledge, this represents the first implementation of the famous cut method to graph polynomials. Finally, we show how the deduced cut method can be applied to calculate some Szeged-like polynomials and corresponding topological indices of para-polyphenyl chains and carbon nanocones.
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来源期刊
CiteScore
4.40
自引率
26.90%
发文量
71
审稿时长
2 months
期刊介绍: MATCH Communications in Mathematical and in Computer Chemistry publishes papers of original research as well as reviews on chemically important mathematical results and non-routine applications of mathematical techniques to chemical problems. A paper acceptable for publication must contain non-trivial mathematics or communicate non-routine computer-based procedures AND have a clear connection to chemistry. Papers are published without any processing or publication charge.
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