Wiener_index_calc: Moleculors Weiner indexes calculator

In FedericoViv/Moleculors:

Description

This function take as input the vertex distance graphical matrix and the V distance distance matrix and return the Wiener Indexes calculated from both Wiener index is calculated as half of the summatory of the summatory of the distances in each row of the graphical matrix. average distance distance degree is calculated as the summatory of the summatory of the distances in each row of the distance distance graphical matrix divided by the number of atoms. D/D index is the defined as half of the summatory of the summatory of the distances in each row of the graphical distance distance matrix. This last two give informations about molecule folding.

Usage

Wiener_index_calc()

Value

Weiner index. Value is stored in Ouput_descp environment.

Examples

Wiener_index_calc()

FedericoViv/Moleculors documentation built on Jan. 17, 2022, 12:23 a.m.