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Abstract For a connected graph G we denote by d ( G , k ) the number of vertex pairs at distance k . The Hosoya polynomial of G is … Abstract For a connected graph G we denote by d ( G , k ) the number of vertex pairs at distance k . The Hosoya polynomial of G is H ( G , x ) = ∑ k ≥0 d ( G , k ) x k . In this paper, analytical formulae for calculating the polynomials of armchair open‐ended nanotubes are given. Furthermore, the Wiener index, derived from the first derivative of the Hosoya polynomial in x = 1, and the hyper‐Wiener index, from one‐half of the second derivative of the Hosoya polynomial multiplied by x in x = 1, can be calculated. © 2006 Wiley Periodicals, Inc. Int J Quantum Chem, 2007
Let G be a graph with edge set E(G) that admits a perfect matching M. A forcing set of M is a subset of M contained in no other perfect … Let G be a graph with edge set E(G) that admits a perfect matching M. A forcing set of M is a subset of M contained in no other perfect matching of G. A complete forcing set of G, recently introduced by Xu et al. [Complete forcing numbers of catacondensed hexagonal systems, J. Comb. Optim., doi: 10.1007/s10878013-9624-x], is a subset of E(G) to which the restriction of any perfect matching M is a forcing set of M. The minimum possible cardinality of a complete forcing set of G is the complete forcing number of G. In this article, we prove theorems for general graphs about explicit relations between the complete forcing numbers under the operation of identifying edges. Regarding its applications to a catacondensed hexagonal system, we prove an unexpectedly linear relationship between the complete forcing number and the Clar number, an important concept on Clar’s aromatic sextet theory in chemistry, propose a linear-time algorithm for computing the complete forcing number and the Clar number and, nally, give an exponential sharp lower bound on the number of minimum complete forcing sets.
AbstractLet G be a chemical graph with vertex set V(G) and the distance between vertices u and v in G. The Hosoya polynomial in variable x of graph G is … AbstractLet G be a chemical graph with vertex set V(G) and the distance between vertices u and v in G. The Hosoya polynomial in variable x of graph G is . In this article, we give an analytical expression for calculating the Hosoya polynomial of one-pentagonal carbon nanocone. Furthermore, a series of distance-based molecular structure descriptors, such as the well-known Wiener index, the hyper-Wiener index, and the Harary index, can be easily obtained. From this point of view, we generalize the results on the Wiener index of one-pentagonal carbon nanocone by Ashrafi and Mohammad-Abadi (4). Wiener indexHosoya polynomialmolecular structure descriptorsone-pentagonal nanoconeHarary index
For a molecular graph G with vertex set V (G) , we denote by dG (u,v ) the distance between vertices u and v in G ... Keywords: Wiener index, … For a molecular graph G with vertex set V (G) , we denote by dG (u,v ) the distance between vertices u and v in G ... Keywords: Wiener index, molecular structure descriptors, one-heptagonal nanocone, hosoya polynomial, hyper-wiener index, harary index.
Abstract For a connected graph G , the Hosoya polynomial of G is defined as H ( G, x ) = ∑ { u,v }⊆ V ( G ) x … Abstract For a connected graph G , the Hosoya polynomial of G is defined as H ( G, x ) = ∑ { u,v }⊆ V ( G ) x d ( u, v ) , where V ( G ) is the set of all vertices of G and d ( u,v ) is the distance between vertices u and v . In this article, we obtain analytical expressions for Hosoya polynomials of TUC 4 C 8 ( R ) nanotubes. Furthermore, the Wiener index and the hyper‐Wiener index can be calculated. © 2008 Wiley Periodicals, Inc. Int J Quantum Chem, 2009
Let G be a molecular graph with bond set E(G) that admits a Kekulé structure. A global forcing set of G is any subset of E(G) such that no two … Let G be a molecular graph with bond set E(G) that admits a Kekulé structure. A global forcing set of G is any subset of E(G) such that no two Kekulé structures of G coincide on S. The number of bonds in a global forcing set of the smallest cardinality is called the global forcing number of G. The global forcing number gives some sort of identification of the minimal amount of information required to specify Kekule structures of a molecular graph. In this article, we give explicit formulae for global forcing numbers of handgun-shaped benzenoid systems. As a corollary, formulae for the global forcing numbers of parallelogram benzenoid systems can be obtained. [J. Sedlar, The global forcing number of the parallelogram polyhex, Discrete Appl. Math. 160 (2012) 2306-2313]. Keywords: Benzenoid hydrocarbon, global forcing number, global forcing set, handgun-shaped benzenoid system, Kekule structure, perfect matching.
In this paper, we construct a bialgebraic and further a Hopf algebraic structure on top of subgraphs of a given graph. Further, we give the dual structure of this Hopf … In this paper, we construct a bialgebraic and further a Hopf algebraic structure on top of subgraphs of a given graph. Further, we give the dual structure of this Hopf algebraic structure. We study the algebra morphisms induced by graph homomorphisms, and obtain a covariant functor from a graph category to an algebra category.
Let Z(G) be the zero forcing number of a simple connected graph G.In this paper, we study the relationship between the zero forcing number of a graph and its (normalized) … Let Z(G) be the zero forcing number of a simple connected graph G.In this paper, we study the relationship between the zero forcing number of a graph and its (normalized) Laplacian eigenvalues.We provide the upper and lower bounds on Z(G) in terms of its (normalized) Laplacian eigenvalues, respectively.Our bounds extend the existing bounds for regular graphs.
The objective of this study is to compute the Kirchhoff index and resistance distance for two classes of windmill graphs, namely the French windmill graph and the Dutch windmill graph. … The objective of this study is to compute the Kirchhoff index and resistance distance for two classes of windmill graphs, namely the French windmill graph and the Dutch windmill graph. In this study, G is considered a simple connected graph with vertex set V (G) and edge set E(G). N is supposed to represent a network derived from G by substituting a 1-ohm resistor for each edge of G. In that case, the resistance between υ,ν ∈ V (G) is considered analogous to the resistance between two equivalent nodes in network N. We employed techniques from electrical network theory to compute the resistance distance and Kirchhoff index. The Kirchhoff index of G is the sum of the resistance distances between all pairs of vertices in G. Our computations revealed specific patterns and relationships in the resistance distances and Kirchhoff indices across different classes of windmill graphs. In addition, the Kirchhoff index and resistance distance are computed in this study for specific generalizations of these graphs. The derived equations can inspire further investigation into the resistance distance and Kirchhoff index in real-world windmill networks. Additionally, they offer a chemical framework for future research, aiding in the determination of molecular structures and characteristics.
The Hosoya polynomial of a graph G with vertex set V (G) is defined as H(G, x )= � {u,v}⊆V (G) x d G(u,v) in variable x, where the sum … The Hosoya polynomial of a graph G with vertex set V (G) is defined as H(G, x )= � {u,v}⊆V (G) x d G(u,v) in variable x, where the sum is over all unordered pairs {u, v} of vertices in G, dG(u, v) is the distance of two vertices u, v in G. In this paper, we investigate Hosoya polynomials of hexagonal trapeziums, tessellations of congruent regular hexagons shaped like trapeziums and give their explicit analytical expressions. As a special case, Hosoya polynomials of hexagonal triangles are obtained. Also, the three well-studied topological indices: Wiener index, hyper-Wiener index and Tratch-Stankevitch-Zefirov index, of hexagonal trapeziums can be easily obtained.
Let G be a molecular graph with vertex set V(G) and dG(u,v) be the topological distance between vertices u and v in G. The Hosoya polynomial H(G,x) of G is … Let G be a molecular graph with vertex set V(G) and dG(u,v) be the topological distance between vertices u and v in G. The Hosoya polynomial H(G,x) of G is a polynomial d x in variable x. In this paper, we obtain an explicit analytical expression for the expected value of the Hosoya polynomial of a random benzenoid chain with n hexagons. Furthermore, as corollaries, the expected values of the well-known topological indices: Wiener index, hyper-Wiener index and TratchStankevitchZefirov index of a random benzenoid chain with n hexagons can be obtained by simple mathematical calculations, which generates the results given by I. Gutman et al. (Wiener numbers of random benzenoid chains, Chem. Phys. Lett. 173 (1990) 403408).
Let G be a simple connected graph with vertex set V(G) and edge set E(G) that admits a perfect matching M. A forcing set of M is a subset of … Let G be a simple connected graph with vertex set V(G) and edge set E(G) that admits a perfect matching M. A forcing set of M is a subset of M contained in no other perfect matchings of G. The minimum cardinality of forcing sets is the forcing number of M. A complete forcing set of G, recently introduced by Xu et al. [Complete forcing numbers of catacondensed hexagonal systems, J. Combin. Optim. 29(4) (2015) 803-814], is a subset S of E(G) on which the restriction of any perfect matching M of G is a forcing set of M. A complete forcing set of the smallest cardinality is called a minimum complete forcing set, and its cardinality is the complete forcing number of G, denoted by cf(G). In this paper, we present the complete forcing sets and complete forcing number of random multiple hexagonal chains.
A graph is called a partial cube if it can be embedded into a hypercube isometrically. In this paper, we study a class of Cayley graphs— Cayley graphs generated by … A graph is called a partial cube if it can be embedded into a hypercube isometrically. In this paper, we study a class of Cayley graphs— Cayley graphs generated by transpositions —and show that a Cayley graph generated by transpositions is a partial cube if and only if is a bubble sort graph. This result enhances a result of Alahmadi et al. in 2016: is a partial cube. As a corollary, we give the analytical expressions of the Wiener indices of bubble sort graphs.
Abstract Partial cubes are the graphs which can be embedded into hypercubes. The cube polynomial of a graph is a counting polynomial of induced hypercubes of , which is defined … Abstract Partial cubes are the graphs which can be embedded into hypercubes. The cube polynomial of a graph is a counting polynomial of induced hypercubes of , which is defined as , where is the number of induced ‐cubes (hypercubes of dimension ) of . The clique polynomial of is defined as , where () is the number of ‐cliques in and . Equivalently, is exactly the independence polynomial of the complement of . The crossing graph of a partial cube is the graph whose vertices are corresponding to the ‐classes of , and two ‐classes are adjacent in if and only if they cross in . In the present paper, we prove that for a partial cube , and the equality holds if and only if is a median graph. Since every graph can be represented as the crossing graph of a median graph, the above necessary‐and‐sufficient result shows that the study on the cube polynomials of median graphs can be transformed to the one on the clique polynomials of general graphs (equivalently, on the independence polynomials of their complements). In addition, we disprove the conjecture that the cube polynomials of median graphs are unimodal.
Let G be a graph with a vertex set V(G), d(G)(u,v) and delta G(v) denote the topological distance between vertices u and v in G and the degree of the … Let G be a graph with a vertex set V(G), d(G)(u,v) and delta G(v) denote the topological distance between vertices u and v in G and the degree of the vertex v in G, respectively. The Schultz polynomial of G is defined as H+ (G) = Sigma ({u,v}subset of V(G)) (delta(G)(u) + delta(G)(v))x(dG(u,v)) and the modified Schultz polynomial of G is defined as H* (G) = Sigma ({u,v}subset of V(G)) (delta(G)(u) + delta(G)(v))x(dG(u,v)) alytical expressions for expected values of Schultz polynomial and modified Schultz polynomial of a random benzenoid chain with n hexagons. Further expected values of some related topological indices are obtained.
Abstract Let G be a connected graph. The resistance distance among two vertices is defined as the effective resistance between the corresponding nodes in the electrical network constructed from G … Abstract Let G be a connected graph. The resistance distance among two vertices is defined as the effective resistance between the corresponding nodes in the electrical network constructed from G by replacing each edge with a unit resistor. The Kirchhoff index is an important distance-based topological index corresponding to graphs, which is the sum of all the resistance distances pairs of G . Let B n be a linear polyomino chain with n squares. The linear triangular chain is a graph with 2 n triangles, characterized by randomly adding an edge to each square of B n so as to make it into two triangular faces. In this paper, by standard techniques of electrical networks and the recursion formula for resistance distances, we characterize the linear triangular chains with extreme Kirchhoff index.
A graph $G$ has a $\mathcal{P}_{\geq k}$-factor if $G$ has a spanning subgraph $H$ such that every component of $H$ is a path of order at least $k$. A graph … A graph $G$ has a $\mathcal{P}_{\geq k}$-factor if $G$ has a spanning subgraph $H$ such that every component of $H$ is a path of order at least $k$. A graph $G$ is $\mathcal{P}_{\geq k}$-factor deleted if $G-e$ has a $\mathcal{P}_{\geq k}$-factor for each edge $e \in E(G)$. In this paper, we study the $\mathcal{P}_{\geq 2}$-factor deleted graphs by their $Q$-index (the largest eigenvalue of the signless Laplacian matrix) and $\mathcal{D}$-index (the largest eigenvalue of the distance matrix). Sufficient conditions (in terms of $Q$-index and $\mathcal{D}$-index) to guarantee that a graph $G$ to be a $\mathcal{P}_{\geq 2}$-factor deleted graph are established.
For a connected graph \(G\), the edge Mostar index \(Mo_e(G)\) is defined as \(Mo_e(G)=\sum\limits_{e=uv \in E(G)}|m_u(e|G) - m_v(e|G)|\), where \(m_u(e|G)\) and \(m_v(e|G)\) are respectively, the number of edges of \(G\) … For a connected graph \(G\), the edge Mostar index \(Mo_e(G)\) is defined as \(Mo_e(G)=\sum\limits_{e=uv \in E(G)}|m_u(e|G) - m_v(e|G)|\), where \(m_u(e|G)\) and \(m_v(e|G)\) are respectively, the number of edges of \(G\) lying closer to vertex \(u\) than to vertex \(v\) and the number of edges of \(G\) lying closer to vertex \(v\) than to vertex \(u\). We determine a sharp upper bound for the edge Mostar index on bicyclic graphs and identify the graphs that achieve the bound, which disproves a conjecture proposed by Liu et al. [Iranian J. Math. Chem. 11(2) (2020) 95--106].
Abstract In an isolate-free graph G , a subset S of vertices is a semitotal dominating set of G if it is a dominating set of G and every vertex … Abstract In an isolate-free graph G , a subset S of vertices is a semitotal dominating set of G if it is a dominating set of G and every vertex in S is within distance 2 of another vertex of S . The semitotal domination number of G , denoted by $\gamma _{t2}(G)$ , is the minimum cardinality of a semitotal dominating set in G . Goddard, Henning and McPillan [‘Semitotal domination in graphs’, Utilitas Math. 94 (2014), 67–81] characterised the trees and graphs of minimum degree 2 with semitotal domination number half their order. In this paper, we characterise all graphs whose semitotal domination number is half their order.
For some positive integer $m$, a real polynomial $P(x)=\sum\limits_{k=0}^ma_kx^k$ with $a_k\geqslant 0$ is called log-concave (resp. ultra log-concave) if $a_k^2\geqslant a_{k-1}a_{k+1}$ (resp. $a_k^2\geqslant \left(1+\frac{1}{k}\right)\left(1+\frac{1}{m-k}\right)\cdot$ $a_{k-1}a_{k+1}$) for all $1\leqslant k\leqslant m-1$. … For some positive integer $m$, a real polynomial $P(x)=\sum\limits_{k=0}^ma_kx^k$ with $a_k\geqslant 0$ is called log-concave (resp. ultra log-concave) if $a_k^2\geqslant a_{k-1}a_{k+1}$ (resp. $a_k^2\geqslant \left(1+\frac{1}{k}\right)\left(1+\frac{1}{m-k}\right)\cdot$ $a_{k-1}a_{k+1}$) for all $1\leqslant k\leqslant m-1$. If $P(x)$ has only real roots, then it is called real-rooted. It is well-known that the conditions of log-concavity, ultra log-concavity and real-rootedness are ever-stronger. For a graph $G$, a dependent set is a set of vertices which is not independent, i.e., the set of vertices whose induced subgraph contains at least one edge. The dependence polynomial of $G$ is defined as $D(G, x):=\sum\limits_{k\geqslant 0}d_k(G)x^k$, where $d_k(G)$ is the number of dependent sets of size $k$ in $G$. Horrocks proved that $D(G, x)$ is log-concave for every graph $G$ [J. Combin. Theory, Ser. B, 84 (2002) 180--185]. In the present paper, we prove that, for a graph $G$, $D(G, x)$ is ultra log-concave if $G$ is $(K_2\cup 2K_1)$-free or contains an independent set of size $|V(G)|-2$, and give the characterization of graphs whose dependence polynomials are real-rooted. Finally, we focus more attention to the problems of log-concavity about independence systems and pose several conjectures closely related the famous Mason's Conjecture.
The objective of this study is to compute the Kirchhoff index and resistance distance for two classes of windmill graphs, namely the French windmill graph and the Dutch windmill graph. … The objective of this study is to compute the Kirchhoff index and resistance distance for two classes of windmill graphs, namely the French windmill graph and the Dutch windmill graph. In this study, G is considered a simple connected graph with vertex set V (G) and edge set E(G). N is supposed to represent a network derived from G by substituting a 1-ohm resistor for each edge of G. In that case, the resistance between υ,ν ∈ V (G) is considered analogous to the resistance between two equivalent nodes in network N. We employed techniques from electrical network theory to compute the resistance distance and Kirchhoff index. The Kirchhoff index of G is the sum of the resistance distances between all pairs of vertices in G. Our computations revealed specific patterns and relationships in the resistance distances and Kirchhoff indices across different classes of windmill graphs. In addition, the Kirchhoff index and resistance distance are computed in this study for specific generalizations of these graphs. The derived equations can inspire further investigation into the resistance distance and Kirchhoff index in real-world windmill networks. Additionally, they offer a chemical framework for future research, aiding in the determination of molecular structures and characteristics.
Abstract Partial cubes are graphs that can be isometrically embedded into hypercubes. Convex cycles play an important role in the study of partial cubes. In this paper, we prove that … Abstract Partial cubes are graphs that can be isometrically embedded into hypercubes. Convex cycles play an important role in the study of partial cubes. In this paper, we prove that a regular partial cube is a hypercube (resp., a Doubled Odd graph, an even cycle of length where ) if and only if all its convex cycles are 4‐cycles (resp., 6‐cycles, ‐cycles). In particular, the partial cubes whose all convex cycles are 4‐cycles are equivalent to almost‐median graphs. Therefore, we conclude that regular almost‐median graphs are exactly hypercubes, which generalizes the result by Mulder—regular median graphs are hypercubes.
Let $G$ be a connected graph. The resistance distance between two vertices $u$ and $v$ of $G$, denoted by $R_{G}[u,v]$, is defined as the net effective resistance between them in … Let $G$ be a connected graph. The resistance distance between two vertices $u$ and $v$ of $G$, denoted by $R_{G}[u,v]$, is defined as the net effective resistance between them in the electric network constructed from $G$ by replacing each edge with a unit resistor. The resistance diameter of $G$, denoted by $D_{r}(G)$, is defined as the maximum resistance distance among all pairs of vertices of $G$. Let $P_n=a_1a_2\ldots a_n$ be the $n$-vertex path graph and $C_{4}=b_{1}b_2b_3b_4b_{1}$ be the 4-cycle. Then the $n$-th block tower graph $G_n$ is defined as the the Cartesian product of $P_n$ and $C_4$, that is, $G_n=P_{n}\square C_4$. Clearly, the vertex set of $G_n$ is $\{(a_i,b_j)|i=1,\ldots,n;j=1,\ldots,4\}$. In [Discrete Appl. Math. 320 (2022) 387--407], Evans and Francis proposed the following conjecture on resistance distances of $G_n$ and $G_{n+1}$: \begin{equation*} \lim_{n \rightarrow \infty}\left(R_{G_{n+1}}[(a_{1},b_1),(a_{n+1},b_3)]-R_{G_{n}}[(a_{1},b_1),(a_{n},b_3)]\right)=\frac{1}{4}. \end{equation*} In this paper, combing algebraic methods and electric network approaches, we confirm and further generalize this conjecture. In addition, we determine all the pair of vertices that reach the resistance diameter of $G_{n}$, which enables us to give an equivalent explanation of the conjecture.
Graph polynomials is one of the important research directions in mathematical chemistry. The coefficients of some graph polynomials, such as matching polynomial and permanental polynomial, are related to structural properties … Graph polynomials is one of the important research directions in mathematical chemistry. The coefficients of some graph polynomials, such as matching polynomial and permanental polynomial, are related to structural properties of graphs. The Hosoya index of a graph is the sum of the absolute value of all coefficients for the matching polynomial. And the permanental sum of a graph is the sum of the absolute value of all coefficients of the permanental polynomial. In this paper, we characterize the second to sixth minimal Hosoya indices of all bicyclic graphs. Furthermore, using the results, the second to sixth minimal permanental sums of all bicyclic graphs are also characterized.
Abstract Partial cubes are the graphs which can be embedded into hypercubes. The cube polynomial of a graph is a counting polynomial of induced hypercubes of , which is defined … Abstract Partial cubes are the graphs which can be embedded into hypercubes. The cube polynomial of a graph is a counting polynomial of induced hypercubes of , which is defined as , where is the number of induced ‐cubes (hypercubes of dimension ) of . The clique polynomial of is defined as , where () is the number of ‐cliques in and . Equivalently, is exactly the independence polynomial of the complement of . The crossing graph of a partial cube is the graph whose vertices are corresponding to the ‐classes of , and two ‐classes are adjacent in if and only if they cross in . In the present paper, we prove that for a partial cube , and the equality holds if and only if is a median graph. Since every graph can be represented as the crossing graph of a median graph, the above necessary‐and‐sufficient result shows that the study on the cube polynomials of median graphs can be transformed to the one on the clique polynomials of general graphs (equivalently, on the independence polynomials of their complements). In addition, we disprove the conjecture that the cube polynomials of median graphs are unimodal.
For a graph [Formula: see text], the Mostar index of [Formula: see text] is the sum of [Formula: see text] over all edges [Formula: see text] of [Formula: see text], … For a graph [Formula: see text], the Mostar index of [Formula: see text] is the sum of [Formula: see text] over all edges [Formula: see text] of [Formula: see text], where [Formula: see text] denotes the number of vertices of [Formula: see text] that have a smaller distance in [Formula: see text] to [Formula: see text] than to [Formula: see text], and analogously for [Formula: see text]. We determine all the graphs that maximize and minimize the Mostar index, respectively, over all trees in terms of some fixed parameters like the number of odd vertices, the number of vertices of degree two, and the number of pendent paths of fixed length.
A perfect code in a graph is an independent set of the graph such that every vertex outside the set is adjacent to exactly one vertex in the set. A … A perfect code in a graph is an independent set of the graph such that every vertex outside the set is adjacent to exactly one vertex in the set. A circulant graph is a Cayley graph of a cyclic group. In this paper we study perfect codes in circulant graphs of degree $p^l - 1$, where $p$ is a prime and $l \ge 1$. We obtain a necessary and sufficient condition for such a circulant graph to admit perfect codes, give a construction of all such circulant graphs which admit perfect codes, and prove a lower bound on the number of distinct perfect codes in such a circulant graph. This extends known results for the case $l=1$ and provides insight on the general problem on the existence and structure of perfect codes in circulant graphs.
A graph pair $(\Gamma, \Sigma)$ is called stable if $\aut(\Gamma)\times\aut(\Sigma)$ is isomorphic to $\aut(\Gamma\times\Sigma)$ and unstable otherwise, where $\Gamma\times\Sigma$ is the direct product of $\Gamma$ and $\Sigma$. A graph is … A graph pair $(\Gamma, \Sigma)$ is called stable if $\aut(\Gamma)\times\aut(\Sigma)$ is isomorphic to $\aut(\Gamma\times\Sigma)$ and unstable otherwise, where $\Gamma\times\Sigma$ is the direct product of $\Gamma$ and $\Sigma$. A graph is called $R$-thin if distinct vertices have different neighbourhoods. $\Gamma$ and $\Sigma$ are said to be coprime if there is no nontrivial graph $\Delta$ such that $\Gamma \cong \Gamma_1 \times \Delta$ and $\Sigma \cong \Sigma_1 \times \Delta$ for some graphs $\Gamma_1$ and $\Sigma_1$. An unstable graph pair $(\Gamma, \Sigma)$ is called nontrivially unstable if $\Gamma$ and $\Sigma$ are $R$-thin connected coprime graphs and at least one of them is non-bipartite. This paper contributes to the study of the stability of graph pairs with a focus on the case when $\Sigma = C_n$ is a cycle. We give two sufficient conditions for $(\Gamma, C_n)$ to be nontrivially unstable, where $n \ne 4$ and $\Gamma$ is an $R$-thin connected graph. In the case when $\Gamma$ is an $R$-thin connected non-bipartite graph, we obtain the following results: (i) if $(\Gamma, K_2)$ is unstable, then $(\Gamma, C_{n})$ is unstable for every even integer $n \geq 4$; (ii) if an even integer $n \ge 6$ is compatible with $\Gamma$ in some sense, then $(\Gamma, C_{n})$ is nontrivially unstable if and only if $(\Gamma, K_2)$ is unstable; (iii) if there is an even integer $n \ge 6$ compatible with $\Gamma$ such that $(\Gamma, C_{n})$ is nontrivially unstable, then $(\Gamma, C_{m})$ is unstable for all even integers $m \ge 6$. We also prove that if $\Gamma$ is an $R$-thin connected graph and $n \ge 3$ is an odd integer compatible with $\Gamma$, then $(\Gamma, C_{n})$ is stable.
For an isolate-free graph G = (V (G), E(G)), a set S ⊆ V (G) is called a semitotal forcing set of G if it is a forcing set (or … For an isolate-free graph G = (V (G), E(G)), a set S ⊆ V (G) is called a semitotal forcing set of G if it is a forcing set (or a zero forcing set) of G and every vertex in S is within distance 2 of another vertex of S. The semitotal forcing number F t2 (G) is the minimum cardinality of a semitotal forcing set in G.In this paper, we prove that if G = K 4 is a connected claw-free cubic graph of order n, then F t2 (G) ≤ 3 8 n + 1.The graphs achieving equality in this bound are characterized, an infinite set of graphs.
For a graph G, the Mostar index of G is the sum of |nu-nv| over all edges e = uv of G, where nu denotes the number of vertices of … For a graph G, the Mostar index of G is the sum of |nu-nv| over all edges e = uv of G, where nu denotes the number of vertices of G that have a smaller distance in G to u than to v, and analogously for nv. In this paper, we obtain a lower bound for the Mostar index on tricyclic graphs and identify those graphs that attain the lower bound.
Abstract Let G be a graph with no isolated vertex. A semitotal forcing set of G is a (zero) forcing set S such that every vertex in S is within … Abstract Let G be a graph with no isolated vertex. A semitotal forcing set of G is a (zero) forcing set S such that every vertex in S is within distance 2 of another vertex of S . The semitotal forcing number $F_{t2}(G)$ is the minimum cardinality of a semitotal forcing set in G . In this paper, we prove that it is NP-complete to determine the semitotal forcing number of a graph. We also prove that if $G\neq K_n$ is a connected graph of order $n\geq 4$ with maximum degree $\Delta \geq 2$ , then $F_{t2}(G)\leq (\Delta-1)n/\Delta$ , with equality if and only if either $G=C_{4}$ or $G=P_{4}$ or $G=K_{\Delta ,\Delta }$ .
Let Z(G) be the zero forcing number of a simple connected graph G.In this paper, we study the relationship between the zero forcing number of a graph and its (normalized) … Let Z(G) be the zero forcing number of a simple connected graph G.In this paper, we study the relationship between the zero forcing number of a graph and its (normalized) Laplacian eigenvalues.We provide the upper and lower bounds on Z(G) in terms of its (normalized) Laplacian eigenvalues, respectively.Our bounds extend the existing bounds for regular graphs.
Partial cubes are graphs that can be isometrically embedded into hypercubes. Convex cycles play an important role in the study of partial cubes. In this paper, we prove that a … Partial cubes are graphs that can be isometrically embedded into hypercubes. Convex cycles play an important role in the study of partial cubes. In this paper, we prove that a regular partial cube is a hypercube (resp., a doubled Odd graph, an even cycle of length $2n$ where $n\geqslant 4$) if and only if all its convex cycles are 4-cycles (resp., 6-cycles, $2n$-cycles). In particular, the partial cubes whose all convex cycles are 4-cycles are equivalent to almost-median graphs, so we obtain that regular almost-median graphs are exactly hypercubes, which generate the result by Mulder [J. Graph Theory, 4 (1980) 107--110] -- regular median graphs are hypercubes.
Partial cubes are the graphs which can be embedded into hypercubes. The {\em cube polynomial} of a graph $G$ is a counting polynomial of induced hypercubes of $G$, which is … Partial cubes are the graphs which can be embedded into hypercubes. The {\em cube polynomial} of a graph $G$ is a counting polynomial of induced hypercubes of $G$, which is defined as $C(G,x):=\sum_{i\geqslant 0}\alpha_i(G)x^i$, where $\alpha_i(G)$ is the number of induced $i$-cubes (hypercubes of dimension $i$) of $G$. The {\em clique polynomial} of $G$ is defined as $Cl(G,x):=\sum_{i\geqslant 0}a_i(G)x^i$, where $a_i(G)$ ($i\geqslant 1$) is the number of $i$-cliques in $G$ and $a_0(G)=1$. Equivalently, $Cl(G, x)$ is exactly the independence polynomial of the complement $\overline{G}$ of $G$. The {\em crossing graph} $G^{\#}$ of a partial cube $G$ is the graph whose vertices are corresponding to the $\Theta$-classes of $G$, and two $\Theta$-classes are adjacent in $G^{\#}$ if and only if they cross in $G$. In the present paper, we prove that for a partial cube $G$, $C(G,x)\leqslant Cl(G^{\#}, x+1)$ and the equality holds if and only if $G$ is a median graph. Since every graph can be represented as the crossing graph of a median graph [SIAM J. Discrete Math., 15 (2002) 235--251], the above necessary-and-sufficient result shows that the study on the cube polynomials of median graphs can be transformed to the one on the clique polynomials of general graphs (equivalently, on the independence polynomials of their complements). In addition, we disprove the conjecture that the cube polynomials of median graphs are unimodal.
For a given connected graph $G$, the edge Mostar index $Mo_e(G)$ is defined as $Mo_e(G)=\sum_{e=uv \in E(G)}|m_u(e|G) - m_v(e|G)|$, where $m_u(e|G)$ and $m_v(e|G)$ are respectively, the number of edges of … For a given connected graph $G$, the edge Mostar index $Mo_e(G)$ is defined as $Mo_e(G)=\sum_{e=uv \in E(G)}|m_u(e|G) - m_v(e|G)|$, where $m_u(e|G)$ and $m_v(e|G)$ are respectively, the number of edges of $G$ lying closer to vertex $u$ than to vertex $v$ and the number of edges of $G$ lying closer to vertex $v$ than to vertex $u$. In this paper, we determine sharp upper bound for edge Mostar index on bicyclic graphs with fixed number of edges, also the graphs that achieve the bound are completely characterized, and thus disprove a conjecture on the edge Mostar index of bicyclic graph in [H. Liu, L. Song, Q. Xiao, Z. Tang, On edge Mostar index of graphs. Iranian J. Math. Chem. 11(2) (2020) 95--106].
For a graph $G$, the Mostar index of $G$ is the sum of $|n_u(e)$ - $n_v(e)|$ over all edges $e=uv$ of $G$, where $n_u(e)$ denotes the number of vertices of … For a graph $G$, the Mostar index of $G$ is the sum of $|n_u(e)$ - $n_v(e)|$ over all edges $e=uv$ of $G$, where $n_u(e)$ denotes the number of vertices of $G$ that have a smaller distance in $G$ to $u$ than to $v$, and analogously for $n_v(e)$. We determine all the graphs that maximize and minimize the Mostar index respectively over all trees in terms of some fixed parameters like the number of odd vertices, the number of vertices of degree two, and the number of pendent paths of fixed length.
For a given connected graph $G$, the edge Mostar index $Mo_e(G)$ is defined as $Mo_e(G)=\sum_{e=uv \in E(G)}|m_u(e|G) - m_v(e|G)|$, where $m_u(e|G)$ and $m_v(e|G)$ are respectively, the number of edges of … For a given connected graph $G$, the edge Mostar index $Mo_e(G)$ is defined as $Mo_e(G)=\sum_{e=uv \in E(G)}|m_u(e|G) - m_v(e|G)|$, where $m_u(e|G)$ and $m_v(e|G)$ are respectively, the number of edges of $G$ lying closer to vertex $u$ than to vertex $v$ and the number of edges of $G$ lying closer to vertex $v$ than to vertex $u$. In this paper, we determine the sharp upper bound for the edge Mostar index on tricyclic graphs with a fixed number of edges, and the graphs that attain the bound are completely characterized.
Let $\Ga = (V, E)$ be a graph and $a, b$ nonnegative integers. An $(a, b)$-regular set in $\Ga$ is a nonempty proper subset $D$ of $V$ such that every … Let $\Ga = (V, E)$ be a graph and $a, b$ nonnegative integers. An $(a, b)$-regular set in $\Ga$ is a nonempty proper subset $D$ of $V$ such that every vertex in $D$ has exactly $a$ neighbours in $D$ and every vertex in $V \setminus D$ has exactly $b$ neighbours in $D$. A $(0,1)$-regular set is called a perfect code, an efficient dominating set, or an independent perfect dominating set. A subset $D$ of a group $G$ is called an $(a,b)$-regular set of $G$ if it is an $(a, b)$-regular set in some Cayley graph of $G$, and an $(a, b)$-regular set in a Cayley graph of $G$ is called a subgroup $(a, b)$-regular set if it is also a subgroup of $G$. In this paper we study $(a, b)$-regular sets in Cayley graphs with a focus on $(0, k)$-regular sets, where $k \ge 1$ is an integer. Among other things we determine when a non-trivial proper normal subgroup of a group is a $(0, k)$-regular set of the group. We also determine all subgroup $(0, k)$-regular sets of dihedral groups and generalized quaternion groups. We obtain necessary and sufficient conditions for a hypercube or the Cartesian product of $n$ copies of the cycle of length $p$ to admit $(0, k)$-regular sets, where $p$ is an odd prime. Our results generalize several known results from perfect codes to $(0, k)$-regular sets.
A network can be analyzed by means of many graph theoretical parameters. In the context of networks analysis, closeness is a structural metric that evaluates a node's significance inside a … A network can be analyzed by means of many graph theoretical parameters. In the context of networks analysis, closeness is a structural metric that evaluates a node's significance inside a network. A cactus is a connected graph in which any block is either a cut edge or a cycle. This paper analyzes the closeness of cacti, we determine the unique graph that minimizes the closeness over all cacti with fixed numbers of vertices and cycles, which solves an open problem proposed by Poklukar \& \v{Z}erovnik [Fundam. Inform. 167 (2019) 219--234].
A graph is called a partial cube if it can be embedded into a hypercube isometrically. In this paper, we study a class of Cayley graphs— Cayley graphs generated by … A graph is called a partial cube if it can be embedded into a hypercube isometrically. In this paper, we study a class of Cayley graphs— Cayley graphs generated by transpositions —and show that a Cayley graph generated by transpositions is a partial cube if and only if is a bubble sort graph. This result enhances a result of Alahmadi et al. in 2016: is a partial cube. As a corollary, we give the analytical expressions of the Wiener indices of bubble sort graphs.
Abstract A topological index Z is proposed for a connected graph G representing the carbon skeleton of a saturated hydrocarbon. The integer Z is the sum of a set of … Abstract A topological index Z is proposed for a connected graph G representing the carbon skeleton of a saturated hydrocarbon. The integer Z is the sum of a set of the numbers p(G,k), which is the number of ways in which such k bonds are so chosen from G that no two of them are connected. For chain molecules Z is closely related to the characteristic polynomial derived from the topological matrix. It is found that Z is correlated well with the topological nature of the carbon skeleton, i.e., the mode of branching and ring closure. Some interesting relations are found, such as a graphical representation of the Fibonacci numbers and a composition principle for counting Z. Correlation of Z with boiling points of saturated hydrocarbons is pointed out.
Abstract The chemist Harold Wiener found 𝒲( G ), the sum of distances between all pairs of vertices in a connected graph G , to be useful as a predictor … Abstract The chemist Harold Wiener found 𝒲( G ), the sum of distances between all pairs of vertices in a connected graph G , to be useful as a predictor of certain physical and chemical properties. The q ‐analogue of 𝒲, called the Wiener polynomial 𝒲( G ; q ), is also useful, but it has few existing useful formulas. We will evaluate 𝒲( G ; q ) for certain graphs G of chemical interest. © 2004 Wiley Periodicals, Inc. Int J Quantum Chem, 2004
The Wiener index is a graphical invariant that has found extensive application in chemistry. We define a generating function, which we call the Wiener polynomial, whose derivative is a q-analog … The Wiener index is a graphical invariant that has found extensive application in chemistry. We define a generating function, which we call the Wiener polynomial, whose derivative is a q-analog of the Wiener index. We study some of the elementary properties of this polynomial and compute it for some common graphs. We then find a formula for the Wiener polynomial of a dendrimer, a certain highly regular tree of interest to chemists, and show that it is unimodal. Finally, we point out a connection with the Poincaré polynomial of a finite Coxeter group. © 1996 John Wiley & Sons, Inc.
Abstract For a connected graph G we denote by d ( G , k ) the number of vertex pairs at distance k . The Hosoya polynomial of G is … Abstract For a connected graph G we denote by d ( G , k ) the number of vertex pairs at distance k . The Hosoya polynomial of G is H ( G , x ) = ∑ k ≥0 d ( G , k ) x k . In this paper, analytical formulae for calculating the polynomials of armchair open‐ended nanotubes are given. Furthermore, the Wiener index, derived from the first derivative of the Hosoya polynomial in x = 1, and the hyper‐Wiener index, from one‐half of the second derivative of the Hosoya polynomial multiplied by x in x = 1, can be calculated. © 2006 Wiley Periodicals, Inc. Int J Quantum Chem, 2007
Higher order analogues of the Wiener number are defined, providing rather precise regression models for a number of physico-chemical properties of alkanes, which certainly are much better than the analogous … Higher order analogues of the Wiener number are defined, providing rather precise regression models for a number of physico-chemical properties of alkanes, which certainly are much better than the analogous models based solely on the Wiener number. The new structure descriptors are defined on the basis of the Wiener–Hosoya polynomial HG(x): the kth extended Wiener index kW is equal to the kth derivative of HG(x), evaluated at x=1, in which case 1W is just the original Wiener number.
L etT be a square triangular grid with n rows and columns of vertices and n an even number. A set of edges E ⊂ E(T ) completely determines perfect … L etT be a square triangular grid with n rows and columns of vertices and n an even number. A set of edges E ⊂ E(T ) completely determines perfect matchings on T if there are no two dif- ferent matchings on T coinciding on E. We establish the upper and the lower bound for the smallest value of |E|, i.e. we show that 5 4 n 2 − 21 2 n +
Handbook of Product Graphs, Second Edition examines the dichotomy between the structure of products and their subgraphs. It also features the design of efficient algorithms that recognize products and their … Handbook of Product Graphs, Second Edition examines the dichotomy between the structure of products and their subgraphs. It also features the design of efficient algorithms that recognize products and their subgraphs and explores the relationship between graph parameters of the product and factors. Extensively revised and expanded, the handbook presents full proofs of many important results as well as up-to-date research and conjectures. Results and Algorithms New to the Second Edition: Cancellation results A quadratic recognition algorithm for partial cubes Results on the strong isometric dimension Computing the Wiener index via canonical isometric embedding Connectivity results A fractional version of Hedetniemis conjecture Results on the independence number of Cartesian powers of vertex-transitive graphs Verification of Vizings conjecture for chordal graphs Results on minimum cycle bases Numerous selected recent results, such as complete minors and nowhere-zero flows The second edition of this classic handbook provides a thorough introduction to the subject and an extensive survey of the field. The first three parts of the book cover graph products in detail. The authors discuss algebraic properties, such as factorization and cancellation, and explore interesting and important classes of subgraphs. The fourth part presents algorithms for the recognition of products and related classes of graphs. The final two parts focus on graph invariants and infinite, directed, and product-like graphs. Sample implementations of selected algorithms and other information are available on the books website, which can be reached via the authors home pages.
Abstract The resistance distance r ij between vertices i and j of a connected (molecular) graph G is computed as the effective resistance between nodes i and j in the … Abstract The resistance distance r ij between vertices i and j of a connected (molecular) graph G is computed as the effective resistance between nodes i and j in the corresponding network constructed from G by replacing each edge of G with a unit resistor. The Kirchhoff index Kf ( G ) is the sum of resistance distances between all pairs of vertices. In this work, closed‐form formulae for Kirchhoff index and resistance distances of circulant graphs are derived in terms of Laplacian spectrum and eigenvectors. Special formulae are also given for four classes of circulant graphs (complete graphs, complete graphs minus a perfect matching, cycles, Möbius ladders M p ). In particular, the asymptotic behavior of Kf ( M p ) as p → ∞ is obtained, that is, Kf ( M p ) grows as ⅙ p 3 as p → ∞. © 2006 Wiley Periodicals, Inc. Int J Quantum Chem, 2007
This report considers the resistance distance as a recently proposed new intrinsic metric on (molecular) graphs, and in particular, the sum R over resistance distances between all pairs of vertices … This report considers the resistance distance as a recently proposed new intrinsic metric on (molecular) graphs, and in particular, the sum R over resistance distances between all pairs of vertices is considered as a graph invariant. It has been proved that R(GN)>R(KN), where GN denotes a connected graph containing N vertices and KN denotes a complete graph containing N vertices. The formulas to obtain the R for two classes of regular graphs (cycles and complete graphs) are derived. Numerical values of R for four Platonic molecules are also given. They ordered the considered Platonic solids as the icosahedron, the cube, the octahedron, and the tetrahedron according to complexity of their Schlegel graphs. This order agrees with those obtained by many other, frequently used descriptors. ©1999 John Wiley & Sons, Inc. Int J Quant Chem 71: 217–225, 1999
A comparative study of structure-boiling point modeling for a set of 180 acyclic and cyclic hydrocarbons (DS-180) and two of its subsets (one containing a selection of 76 acyclic and … A comparative study of structure-boiling point modeling for a set of 180 acyclic and cyclic hydrocarbons (DS-180) and two of its subsets (one containing a selection of 76 acyclic and cyclic alkanes (DS-76), and the other containing 104 (DS-104) mono- and polycyclic butanes through octanes) using several known and novel distance-related indices is reported. The distance-related indices used were as follows: Wiener index, hyper-Wiener index, detour index, hyper-detour index, Harary index, Pasaréti index, Vérhalom index, Wiener-sum index, inverse Wiener-sum index and the product-form version of the Wiener index. Additional indices used were the total number of paths, the Hosoya Z index, the total walk count index, the number of carbon atoms, and the number of rings in the hydrocarbon. The best models for predicting the boiling points of 76, 104, and 180 acyclic and cyclic alkanes contain the natural logarithm of the cross-products of the Hosoya and detour index and of the Pasaréti index and the number of rings. This result extends earlier work by us and Rücker and Rücker on the use of the Wiener, detour, and Hosoya indices in modeling boiling points of alkanes and cycloalkanes. It also supports later work by Rücker and Rücker on the use of the descriptor combination for the same purpose.
Let $G$ be a graph that admits a perfect matching. A {\sf forcing set} for a perfect matching $M$ of $G$ is a subset $S$ of $M$, such that $S$ … Let $G$ be a graph that admits a perfect matching. A {\sf forcing set} for a perfect matching $M$ of $G$ is a subset $S$ of $M$, such that $S$ is contained in no other perfect matching of $G$. This notion originally arose in chemistry in the study of molecular resonance structures. Similar concepts have been studied for block designs and graph colorings under the name {\sf defining set}, and for Latin squares under the name {\sf critical set}. Recently several papers have appeared on the study of forcing sets for other graph theoretic concepts such as dominating sets, orientations, and geodetics. Whilst there has been some study of forcing sets of matchings of hexagonal systems in the context of chemistry, only a few other classes of graphs have been considered. Here we study the spectrum of possible forced matching numbers for the grids $P_m \times P_n$, discuss the concept of a forcing set for some other specific classes of graphs, and show that the problem of finding the smallest forcing number of graphs is \NP--complete.
A $k$-tree is a spanning tree in which every vertex has degree at most $k$. In this paper, we provide a sufficient condition for the existence of a $k$-tree in … A $k$-tree is a spanning tree in which every vertex has degree at most $k$. In this paper, we provide a sufficient condition for the existence of a $k$-tree in a connected graph with fixed order in terms of the adjacency spectral radius and the signless Laplacian spectral radius, respectively. Also, we give a similar condition for the existence of a perfect matching in a balanced bipartite graph with fixed order and minimum degree.
We demonstrate a scheme for controlling a large quantum system by acting on a small subsystem only. The local control is mediated to the larger system by some fixed coupling … We demonstrate a scheme for controlling a large quantum system by acting on a small subsystem only. The local control is mediated to the larger system by some fixed coupling Hamiltonian. The scheme allows us to transfer arbitrary and unknown quantum states from a memory to the large system (``upload access'') as well as the inverse (``download access''). We study the sufficient conditions of the coupling Hamiltonian and give lower bounds on the fidelities for downloading and uploading.
Abstract For a Kekulé structure we consider the smallest number of placements of double bonds such that the full Kekulé structure on the given parent graph is fully determined. These … Abstract For a Kekulé structure we consider the smallest number of placements of double bonds such that the full Kekulé structure on the given parent graph is fully determined. These numbers for each Kekulé structure of the parent graph sum to a novel structural invariant F , called the degree of freedom of the graph. Some qualitative characteristics are identified, and it is noted that apparently it behaves differently from a couple of other invariants related to Kekulé structures.
Let $G$ be a simple connected graph with a perfect matching. Let ${; ; ; \cal M}; ; ; (G)$ denote the set of all perfect matchings in $G$, and … Let $G$ be a simple connected graph with a perfect matching. Let ${; ; ; \cal M}; ; ; (G)$ denote the set of all perfect matchings in $G$, and $f: {; ; ; \cal M}; ; ; (G) \rightarrow \{; ; ; 0, 1\}; ; ; ^{; ; ; |E(G)|}; ; ; $ a characteristic function of perfect matchings of $G$. Any set $S \subseteq E(G)$ such that $f \left | _S \right .$ is an injection is called a global forcing set in $G$, and the cardinality of smallest such $S$ is called the global forcing number of $G$. In this paper we first establish lower bounds on this quantity and show how it can be computed for certain classes of composite graphs, and then we prove an explicit formula for global forcing number of the grid graph $R_{; ; ; p, q}; ; ; = P_p \times P_q$. We also briefly consider a vertex global forcing number of grid graphs and present an explicit formula for it. In the last section we give explicit formulas for global forcing numbers of complete graphs and discuss some further developments.
The quadrilateral graph Q(G) is obtained from G by replacing each edge in G with two parallel paths of length 1 and 3, whereas the pentagonal graph W(G) is obtained … The quadrilateral graph Q(G) is obtained from G by replacing each edge in G with two parallel paths of length 1 and 3, whereas the pentagonal graph W(G) is obtained from G by replacing each edge in G with two parallel paths of length 1 and 4. In this paper, closed-form formulas of resistance distance and Kirchhoff index for quadrilateral graph and pentagonal graph are obtained whenever G is an arbitrary graph.
Abstract An expanded form of the Wiener number is suggested for characterization of molecular graphs and structure‐property correlations. The simple, computer‐oriented method for counting of the novel index is briefly … Abstract An expanded form of the Wiener number is suggested for characterization of molecular graphs and structure‐property correlations. The simple, computer‐oriented method for counting of the novel index is briefly discussed.
Probability theory, like much of mathematics, is indebted to physics as a source of problems and intuition for solving these problems. Unfortunately, the level of abstraction of current mathematics often … Probability theory, like much of mathematics, is indebted to physics as a source of problems and intuition for solving these problems. Unfortunately, the level of abstraction of current mathematics often makes it difficult for anyone but an expert to appreciate this fact. Random Walks and Electric Networks looks at the interplay of physics and mathematics in terms of an example — the relation between elementary electric network theory and random walks —where the mathematics involved is at the college level.
The graph algebra is a commutative, cocommutative, graded, connected incidence Hopf algebra, whose basis elements correspond to finite graphs, and whose Hopf product and coproduct admit simple combinatorial descriptions. We … The graph algebra is a commutative, cocommutative, graded, connected incidence Hopf algebra, whose basis elements correspond to finite graphs, and whose Hopf product and coproduct admit simple combinatorial descriptions. We give a new formula for the antipode in the graph algebra in terms of acyclic orientations; our formula contains many fewer terms than Takeuchi's and Schmitt's more general formulas for the antipode in an incidence Hopf algebra. Applications include several formulas (some old and some new) for evaluations of the Tutte polynomial.
Abstract The Wiener index, or the Wiener number, also known as the “sum of distances” of a connected graph, is one of the quantities associated with a molecular graph that … Abstract The Wiener index, or the Wiener number, also known as the “sum of distances” of a connected graph, is one of the quantities associated with a molecular graph that correlates nicely to physical and chemical properties, and has been studied in depth. An index proposed by Schultz is shown to be related to the Wiener index for trees, and Ivan Gutman proposed a modification of the Schultz index with similar properties. We deduce a similar relationship between these three indices for catacondensed benzenoid hydrocarbons (graphs formed of concatenated hexagons, or hexagonal chains, or sometimes acenes). Indeed, we may define three families of generalized Wiener indices, which include the Schultz and Modified Schultz indices as special cases, such that similar explicit formulae for all generalized Wiener indices hold on hexagonal chains. We accomplish this by first giving a more refined proof of the formula for the standard Wiener index of a hexagonal chain, then extending it to the generalized Wiener indices via the notion of partial Wiener indices. Finally, we discuss possible extensions of the result. © 2005 Wiley Periodicals, Inc. Int J Quantum Chem, 2006
An algorithm with a complexity linear in the number of vertices is proposed for the computation of the Hyper-Wiener index of chemical trees. This complexity is the best possible. Computational … An algorithm with a complexity linear in the number of vertices is proposed for the computation of the Hyper-Wiener index of chemical trees. This complexity is the best possible. Computational experience for alkanes is reported.