mirror of
https://github.com/openbabel/openbabel.git
synced 2026-07-31 08:37:55 -05:00
Noel O'Boyle
f95f7182df
create a vector of unisigned ints, required to use the Fingerprint class. Also, added lines to prevent warnings due to shadowed classes in obiter.h.
118 lines
3.6 KiB
OpenEdge ABL
118 lines
3.6 KiB
OpenEdge ABL
%module openbabel
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%{
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// used to set import/export for Cygwin DLLs
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#ifdef WIN32
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#define USING_OBDLL
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#endif
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#include <math.h>
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#include <openbabel/obutil.h>
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#include <openbabel/rand.h>
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#include <openbabel/math/vector3.h>
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#include <openbabel/math/matrix3x3.h>
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#include <openbabel/generic.h>
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#include <openbabel/base.h>
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#include <openbabel/mol.h>
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#include <openbabel/atom.h>
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#include <openbabel/bond.h>
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#include <openbabel/residue.h>
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#include <openbabel/internalcoord.h>
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#include <openbabel/ring.h>
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#include <openbabel/obconversion.h>
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#include <openbabel/oberror.h>
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#include <openbabel/fingerprint.h>
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#include <openbabel/data.h>
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#include <openbabel/parsmart.h>
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%}
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%include "std_map.i"
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%include "std_vector.i"
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%include "std_string.i"
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namespace std {
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%template (vectorInt) vector<int>;
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%template (vectorUnsignedInt) vector<unsigned int>;
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%template (vvInt) vector< vector<int> >;
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%template (vectorDouble) vector<double>;
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%template (vVector3) vector<OpenBabel::vector3>;
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%template (vectorMol) vector<OpenBabel::OBMol>;
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%template (vectorBond) vector<OpenBabel::OBBond>;
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%template (vectorResidue) vector<OpenBabel::OBResidue>;
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%template (vectorRing) vector<OpenBabel::OBRing>;
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%template (vectorData) vector<OpenBabel::OBGenericData*>;
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}
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%import <openbabel/babelconfig.h>
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%apply std::string &OUTPUT { std::string &to };
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%include <openbabel/data.h>
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%include <openbabel/rand.h>
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%include <openbabel/obutil.h>
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%include <openbabel/math/vector3.h>
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%import <openbabel/math/matrix3x3.h>
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%include <openbabel/generic.h>
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%include <openbabel/base.h>
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%import <openbabel/chains.h>
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%import <openbabel/bitvec.h>
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%import <openbabel/typer.h>
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%include <openbabel/oberror.h>
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%include <openbabel/obconversion.h>
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%include <openbabel/residue.h>
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%include <openbabel/internalcoord.h>
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%include <openbabel/atom.h>
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%include <openbabel/bond.h>
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%include <openbabel/mol.h>
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%include <openbabel/ring.h>
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%include <openbabel/parsmart.h>
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%include <openbabel/fingerprint.h>
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# The following %ignores avoid warning messages due to shadowed classes.
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# This does not imply a loss of functionality as (in this case)
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# the shadowed class is identical (from the point of view of SWIG) to
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# the shadowing class.
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# This is because C++ references (&) are transformed by SWIG back into
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# pointers, so that OBAtomIter(OBMol &) would be treated the same as
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# OBAtomIter(OBMol *).
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%ignore OBMolAtomIter(OBMol &);
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%ignore OBMolAtomDFSIter(OBMol &);
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%ignore OBMolAtomBFSIter(OBMol &);
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%ignore OBMolBondIter(OBMol &);
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%ignore OBResidueIter(OBMol &);
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%ignore OBAtomAtomIter(OBAtom &);
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%ignore OBAtomBondIter(OBAtom &);
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%ignore OBResidueAtomIter(OBResidue &);
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%rename(inc) OpenBabel::OBMolAtomIter::operator++;
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%rename(inc) OpenBabel::OBMolBondIter::operator++;
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%rename(inc) OpenBabel::OBAtomAtomIter::operator++;
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%rename(inc) OpenBabel::OBAtomBondIter::operator++;
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%rename(good) OpenBabel::OBMolAtomIter::operator bool;
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%rename(good) OpenBabel::OBMolBondIter::operator bool;
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%rename(good) OpenBabel::OBAtomAtomIter::operator bool;
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%rename(good) OpenBabel::OBAtomBondIter::operator bool;
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%rename(good) OpenBabel::OBMolAtomIter::operator bool;
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%rename(deref) OpenBabel::OBMolAtomIter::operator->;
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%rename(deref) OpenBabel::OBMolBondIter::operator->;
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%rename(deref) OpenBabel::OBAtomAtomIter::operator->;
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%rename(deref) OpenBabel::OBAtomBondIter::operator->;
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%rename(inc) OpenBabel::OBResidueIter::operator++;
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%rename(inc) OpenBabel::OBResidueAtomIter::operator++;
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%rename(good) OpenBabel::OBResidueIter::operator bool;
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%rename(good) OpenBabel::OBResidueAtomIter::operator bool;
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%rename(deref) OpenBabel::OBResidueAtomIter::operator->;
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%rename(deref) OpenBabel::OBResidueBondIter::operator->;
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%include <openbabel/obiter.h>
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