source: molecuilder/src/graph.hpp@ 972706

/** \file graph.cpp
 * 
 * Function definitions for the class graph.
 * 
 */

#ifndef GRAPH_HPP_
#define GRAPH_HPP_

// include config.h
#ifdef HAVE_CONFIG_H
#include <config.h>
#endif

// STL headers
#include <map>
#include <multimap>

#include "molecule.hpp"

class Graph;
class SubGraph;
class Node;
class Edge;

/***************************************** Various graph-related STL defines ********************************/

#define NodeMap pair < int, class Node* >
#define EdgeMap multimap < class Node*, class Edge* >

/***************************************** Definition for classes ********************************/

/** Graph class containing the graphs behind molecules.
 */
class Graph
{
        NodeMap ListOfNodes;            //!< tree-list of all nodes in this graph
        EdgeMap ListOfEdges;            //!< tree-multi-list of all nodes, referenced to node id
};

/** Class describing subgraphs of the Class \a Graph.
 * SubGraph has its own node and edge lists, however also a pointer to its father graph
 * and hence access to its list as well. 
 */
class SubGraph : class Graph
{
        class Graph *FatherGraph;               //!< Graph whose subgraph we are
};

/** Class containing the nodes of a graph.
 */
class Node
{
        int     id;                             //!< individual id of the node
        char *Name;             //!< Name of the node for pretty printing
};

/** Class containing egdes in a Graph strructure.
 */
class Edge
{
        class Node *leftnode;           //!< pointer to first node
        class Node *atomnode;           //!< pointer to second node
};



#endif /*GRAPH_HPP_*/