Mosquitoes are a great threat to human health date and subject of interdisciplinary research involving scientists from many areas. Recently much attention has been put novel approaches mosquito repellent products that involve the use materials, such as carbon nanomaterials, where it is essential determine their properties. This discusses full molecular characterization nanotubes (CNTs) produced...

We introduce a novel predictive statistical modeling technique called Hybrid Radial Basis Function Neural Networks (HRBF-NN) as a forecaster. HRBF-NN is a flexible forecasting technique that integrates regression trees, ridge regression, with radial basis function (RBF) neural networks (NN). We develop a new computational procedure using model selection based on information-theoretic principles...

Several different topological indices (the carbon number, the Wiener index, the Balaban dis­ tance sum connectivity index, the Randic molecular identification number, and the Randic molecular connectivity indices °/, 2%, 3̂ p and 3/ c) were employed in the correlation of the velocity of ultrasonic sound in a variety of alkane and alcohol species. Using linear regression analyses and published so...

Symmetry properties of the three 10-cages on 70 vertices are investigated. Being bipartite, these graphs are Levi graphs of triangleand quadrangle-free (353) con!gurations. For each of these graphs a Hamilton cycle is given via the associated LCF notation. Furthermore, the automorphism groups of respective orders 80, 120, and 24 are computed. A special emphasis is given to the Balaban 10-cage, ...

In this paper, we examine the uniqueness (discrimination power) of a newly proposed graph invariant based on the matrix DMAX defined by Randić et al. In order to do so, we use exhaustively generated graphs instead of special graph classes such as trees only. Using these graph classes allow us to generalize the findings towards complex networks as they usually do not possess any structural const...

We present an application of the chemical graph theory approach for generating elementary reactions of complex systems. Molecular species are naturally represented by graphs, which are identified by their vertices and edges where vertices are atom types and edges are bonds. The mechanism is generated using a set of reaction patterns (sub-graphs). These subgraphs are the internal representations...

Recently, a new molecular graph matrix, Harary matrix, was defined in honor of Professor Frank Harary, and new graph invariants (local and global) based on it were also defined and researched, Harary index is one of these invariants. The Harary matrix can be used to derive a variant of the Balaban index, Harary index was also successfully tested in several structure-property relationships, so i...