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A novel set of Wiener indices
Xin-hua Li1, Zu-guang Li, Mao-lin Hu
1School of Chemistry and Materials Science, Wenzhou Normal College, Wenzhou, Zhejiang 325027, PR China. lixinhua01@263.net
Journal of Molecular Graphics & Modelling
|August 23, 2003
Abstract:
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.