ChainBuilder Class Reference

This class provides methods for analysis of the chains in a molecule. More...

#include <chainBuilder.h>

List of all members.

Public Member Functions
	ChainBuilder ()
	Default-Constructor.
	~ChainBuilder ()
	Destructor.
vector< vector< Atom * > >	buildChains (System &molecule_sys)
	Determines the the main chain and side chains of a structure diagram.
Static Public Member Functions
bool	compareChains (const vector< Atom * > &x, const vector< Atom * > &y)
	comparator for sorting the chains by their length

---

Detailed Description

This class provides methods for analysis of the chains in a molecule.

---

Member Function Documentation

vector<vector<Atom*> > ChainBuilder::buildChains (  System &  molecule_sys  )

Determines the the main chain and side chains of a structure diagram. Parameters: molecule_sys  the input System Returns: the chains sorted by their length

bool ChainBuilder::compareChains (  const vector< Atom * > &  x, const vector< Atom * > &  y )  [static]

comparator for sorting the chains by their length Parameters: x  chain y  chain