Hosoya entropy of fullerene graphs

Modjtaba Ghorbani; Matthias Dehmer; Mina Rajabi-Parsa; Frank Emmert-Streib; Abbe Mowshowitz

doi:10.1016/j.amc.2019.01.024

Hosoya entropy of fullerene graphs

Modjtaba Ghorbani, Matthias Dehmer^*, Mina Rajabi-Parsa, Frank Emmert-Streib, Abbe Mowshowitz

^*Corresponding author for this work

Research Center Steyr

Research output: Contribution to journal › Article › peer-review

20 Citations (Scopus)

Abstract

Entropy-based methods are useful tools for investigating various problems in mathematical chemistry, computational physics and pattern recognition. In this paper we introduce a general framework for applying Shannon entropy to fullerene graphs, and used it to investigate their properties. We show that important physical properties of these molecules can be determined by applying Hosoya entropy to their corresponding graphs.

Original language	English
Pages (from-to)	88-98
Number of pages	11
Journal	Applied Mathematics and Computation
Volume	352
DOIs	https://doi.org/10.1016/j.amc.2019.01.024
Publication status	Published - 1 Jul 2019

Keywords

Fullerene graphs
Graph automorphism
Graph entropy

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10.1016/j.amc.2019.01.024

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title = "Hosoya entropy of fullerene graphs",

abstract = "Entropy-based methods are useful tools for investigating various problems in mathematical chemistry, computational physics and pattern recognition. In this paper we introduce a general framework for applying Shannon entropy to fullerene graphs, and used it to investigate their properties. We show that important physical properties of these molecules can be determined by applying Hosoya entropy to their corresponding graphs.",

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AU - Dehmer, Matthias

AU - Rajabi-Parsa, Mina

AU - Emmert-Streib, Frank

AU - Mowshowitz, Abbe

PY - 2019/7/1

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N2 - Entropy-based methods are useful tools for investigating various problems in mathematical chemistry, computational physics and pattern recognition. In this paper we introduce a general framework for applying Shannon entropy to fullerene graphs, and used it to investigate their properties. We show that important physical properties of these molecules can be determined by applying Hosoya entropy to their corresponding graphs.

AB - Entropy-based methods are useful tools for investigating various problems in mathematical chemistry, computational physics and pattern recognition. In this paper we introduce a general framework for applying Shannon entropy to fullerene graphs, and used it to investigate their properties. We show that important physical properties of these molecules can be determined by applying Hosoya entropy to their corresponding graphs.

KW - Fullerene graphs

KW - Graph automorphism

KW - Graph entropy

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DO - 10.1016/j.amc.2019.01.024

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VL - 352

SP - 88

EP - 98

JO - Applied Mathematics and Computation

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ER -

Hosoya entropy of fullerene graphs

Abstract

Keywords

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