On the Calculation of the Molecular Descriptor χ’/χ

Autor: Dejan Plavsic, Milan Šoškić, Nella Lers
Rok vydání: 1998
Předmět:
Zdroj: Journal of Chemical Information and Computer Sciences. 38:889-892
ISSN: 0095-2338
DOI: 10.1021/ci980034e
Popis: The molecular descriptor χ’/χ was recently introduced by Randic. The explicit formula for calculation of the χ’/χ index is derived. The formula provides an easy method to calculate the χ’/χ index for any connected graph. The advantages of the formula over the algorithm proposed by Randic et al. are pointed out.
Databáze: OpenAIRE