Molecular topological index

Schultz MTI by valence vertex degrees Gutman Molecular Topological Index Gutman MTI by valence vertex degrees Xu index... 

Molecular Topological Index The molecular topological index (MTI) is derived from v, calculated as the sum of D and A premultiplied by the row vector v [11] ... 

Xu, L., H.-Y. Wang, and Q. Su, A Newly Proposed Molecular Topological Index for the Discrimination of Cis/Trans Isomers and for the Studies of QSAR /QSPR. Comput. Chem., 1992 16, 187-194. 

Balaban distance connectivity index Schultz molecular topological index Kier shape descriptors eigenvalues of the adjacency matrix eigenvalues of the distance matrix Mohar indices Kirchhoff number detour index... 

Gutman molecular topological index -> Schultz molecular topological index... 

The Harary index H (also called Harary number) is a molecular topological index [Ivanciuc et al, 1993b Plavsic et al, 1993b] derived from the -> reciprocal distance matrix D- by the Wiener operator YF ... 

A Schultz-type topological index - Gutman molecular topological index Sq - was also defined by Gutman [Gutman, 1994b], as ... 

A generalization of the Schultz molecular topological index to account for heteroatoms and multiple bonds was proposed based on the - Barysz distance matrix. 

Defined in analogy with the - Schultz molecular topological index MTI are -> molecular descriptors based on a product of square Ax A matrices, the - adjacency matrix A being obligatory [Diudea et al, 1997b Diudea and Randic, 1998 Diudea and Gutman, 1998],... 

The most popular molecular descriptors based on the vertex degree are the - connectivity indices, Zagreb indices, - Schultz molecular topological index, and - degree distance of the graph. 

Gutman, I. (1994b). Selected Properties of the Schultz Molecular Topological Index. J.Chem.Inf. Comput.Sci., 34,1087-1089. 

Gutman, I. and Klavzar, S. (1997). Bounds for the Schultz Molecular Topological Index of Benzenoid Systems in Terms of the Wiener Index. J.Chem.Inf.ComputScL, 37,741-744. 

Juric, A., Gagro, M., Nikolic, S. and Trinajstic, N. (1992). Molecular Topological Index An Application in the QSAR Study of Toxicity of Alcohols. J.Math.Chem., 11,179-186. 

Li, L.-F., Zhang, Y. and You, X.-Z. (1995). Molecular Topological Index and Its Application. 4. Relationships with the Diamagnetic Susceptibilities of AUsyl-IVA Group Organometallic HaUdes. J.Chem.InfComput.Sci., 35,697-700. 

---