Chemical Descriptors Library: make_adjacency_matrix()
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Make Adjacency Matrix
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make_adjacency_matrix()
Prototype
template <class VertexDescSymmMatrix, class Molecule>
void make_adjacency_matrix (VertexDescSymmMatrix& am, Molecule& m);
Arguments
| Parameter | Description | Models |
| am |
The adjacency matrix to be filled |
UBlas matrix. value_type = vertex_descriptor |
| m |
The molecule |
CDL molecule |
Description
Fill the matrix with the adjacency matrix of the molecule. The matrix must
be properly sized.
Definition
#include <morpho/cdl/molecule/algorithms/mol_algo.hpp>
Preconditions
am.size1() == am.size2() == m.num_atoms().
Complexity
O(E)
References
Copyright © Vladimir Josef Sykora & Morphochem AG 2003
Copyright © Vladimir Josef Sykora 2003-2006
