Open Babel  3.0
Namespaces | Functions
query.cpp File Reference
#include <openbabel/query.h>
#include <openbabel/mol.h>
#include <openbabel/atom.h>
#include <openbabel/obiter.h>
#include <openbabel/obconversion.h>
#include <algorithm>

Namespaces

 OpenBabel
 

Functions

OBQuery * CompileMoleculeQuery (OBMol *mol, const OBBitVec &mask=OBBitVec())
 
OBQuery * CompileSmilesQuery (const std::string &smiles, const OBBitVec &mask=OBBitVec())
 

Detailed Description

OBQuery, OBQueryAtom & OBQueryBond classes.