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M. B. AHMADI1,* , Z. SEIF1
The Merrifield–Simmons index, i(G) , of a molecular graph G is important in structural chemistry and defined as the number of subsets of the vertex set, in which any two vertices are non-adjacent, i.e., the number of independent-vertex sets of G . In this paper for calculating Merrifield–Simmons index, we formulate an integer linear programming problem to compute the k-independent set of G and then we solve it by AIMMS software..
Merrifield–Simmons index, Molecular graph, AIMMS software, Integer programming.
M. B. AHMADI, Z. SEIF, On computing Merrifield–Simmons index, Optoelectronics and Advanced Materials - Rapid Communications, 4, 1, January 2010, pp.56-58 (2010).
Submitted at: Nov. 5, 2009
Accepted at: Jan. 19, 2010
Optoelectronics and Advanced Materials - Rapid Communications
(2023): 0.5 - 2023 Journal Citation Reports (Clarivate Analytics, 2024)
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