Eadj_matrix_full: Moleculors edge adjacency matrix full

Description Usage Arguments Value Examples

View source: R/Molecular_graph_V01.R

Description

This function require the cartesian matrix and the adjacency matrix for the vertexes in order to compute the edge cartesian matrix and the adjacency edges matrices.

Usage

1
Eadj_matrix_full(Cart_Input)

Arguments

Cart_Input

Cartesian coordinates of the molecule without the hydrogen atoms

Value

Edge adjacency matrix for the loaded molecule. Matrix is stored in Mol_mat environment.

Examples

1

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