Open Babel  3.0
RDKitConv.h
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1 #include <openbabel/mol.h>
2 #include <openbabel/obiter.h>
3 #include <graphmol/RWMol.h>
4 #include <graphmol/Atom.h>
5 
7 RDKit::RWMol OBMolToRWMol(OpenBabel::OBMol* pOBMol);
8 
10 //! \brief Allow conversion from OBMol to RDKit RWMol
OpenBabel::OBMol
Molecule Class.
Definition: mol.h:118
mol.h
Handle molecules. Declarations of OBMol, OBAtom, OBBond, OBResidue. (the main header for Open Babel) ...
OBMolToRWMol
RDKit::RWMol OBMolToRWMol(OpenBabel::OBMol *pOBMol)
Convert OpenBabel OBMol to and from RGKit molecules.
obiter.h
STL-style iterators for Open Babel.
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