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Title:
A Method for Computing the Merrifield-Simmons Index on Benzenoid Systems
Authors:
Guillermo De Ita, Pedro Bello, Meliza Contreras
doi:
Volume
89
Issue
1
Year
2023
Pages
245-270
Abstract We present a method for computing the Merrifield-Simmons index on some basic graphs. For example, our proposal works on paths, simple cycles, trees, and we show that the method can be extended to process benzenoid systems \(H_{r,t}\) with a total of \(r \cdot t\) hexagons. In the case of benzenoid systems, our method consists of performing a linear-time Hamiltonian walking on an isomorphic hexagonal grid from \(H_{r,t}\,\), at the same time that the number of independent sets are being computed incrementally. Our method improves the asymptotic behavior of the time-complexity with respect to the transfer matrix method, which is the classic method for computing the Merrifield-Simmons index on grid graphs, even for benzenoid systems.

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