A novel set of Wiener indices.
According to the definition of molecular connectivity and the definition of the Wiener index, a novel set of Wiener indices (mV(t)) were defined, named novel Wiener index. The potential usefulness of the novel Wiener index in QSAR/QSPR is evaluated by its correlation with a number of C(3)-C(8) alkanes and by a favorable comparison with models based on molecular connectivity index and Wiener index.
Li
Xin-hua
XH
School of Chemistry and Materials Science, Wenzhou Normal College, Wenzhou, Zhejiang 325027, PR China. lixinhua01@263.net
Li
Zu-guang
ZG
Hu
Mao-lin
ML
D008433:Mathematics; D008956:Models, Chemical; D015394:Molecular Structure; D021281:Quantitative Structure-Activity Relationship; D013223:Statistics as Topic