mirror of
https://github.com/openbabel/openbabel.git
synced 2025-02-25 18:55:23 -06:00
889fba2d20
* scripts/openbabel-java.i, scripts/openbabel-perl.i,
scripts/openbabel-ruby.i: Fix script bindings. Now compile
cleanly. Perl still needs work to pass tests.
* include/openbabel/math/spacegroup.h, include/openbabel/plugin.h:
Minor updates for SWIG compatibility.
151 lines
3.8 KiB
OpenEdge ABL
151 lines
3.8 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 <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/math/transform3d.h>
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#include <openbabel/math/spacegroup.h>
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#include <openbabel/generic.h>
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#include <openbabel/griddata.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/plugin.h>
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#include <openbabel/fingerprint.h>
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#include <openbabel/descriptor.h>
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#include <openbabel/format.h>
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#include <openbabel/forcefield.h>
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#include <openbabel/op.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 (vectorString) vector<std::string>;
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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 (vectorpRing) vector<OpenBabel::OBRing*>;
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%template (vectorData) vector<OpenBabel::OBGenericData*>;
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}
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%inline %{
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OpenBabel::OBPairData *toPairData(OpenBabel::OBGenericData *data) {
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return (OpenBabel::OBPairData *) data;
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}
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OpenBabel::OBUnitCell *toUnitCell(OpenBabel::OBGenericData *data) {
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return (OpenBabel::OBUnitCell *) data;
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}
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%}
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%ignore *::operator=;
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%ignore *::operator*;
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%ignore *::operator*=;
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%ignore *::operator+;
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%ignore *::operator+=;
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%ignore *::operator-;
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%ignore *::operator-=;
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%ignore *::operator++;
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%ignore *::operator--;
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%ignore *::operator/;
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%ignore *::operator/=;
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%ignore *::operator bool;
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%import <openbabel/babelconfig.h>
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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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%include <openbabel/math/matrix3x3.h>
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%include <openbabel/math/transform3d.h>
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%include <openbabel/math/spacegroup.h>
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%include <openbabel/base.h>
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%include <openbabel/generic.h>
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%include <openbabel/griddata.h>
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%include <openbabel/chains.h>
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%include <openbabel/bitvec.h>
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%include <openbabel/typer.h>
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%include <openbabel/plugin.h>
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%include <openbabel/oberror.h>
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%include <openbabel/format.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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%include <openbabel/descriptor.h>
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%include <openbabel/forcefield.h>
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%include <openbabel/op.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 OBAtomAtomIter(OBAtom &);
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%ignore OBAtomBondIter(OBAtom &);
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%ignore OBMolAngleIter(OBMol &);
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%ignore OBMolAtomIter(OBMol &);
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%ignore OBMolAtomBFSIter(OBMol &);
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%ignore OBMolAtomDFSIter(OBMol &);
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%ignore OBMolBondIter(OBMol &);
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%ignore OBMolPairIter(OBMol &);
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%ignore OBMolRingIter(OBMol &);
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%ignore OBMolTorsionIter(OBMol &);
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%ignore OBResidueIter(OBMol &);
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%ignore OBResidueAtomIter(OBResidue &);
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%ignore SpaceGroup::RegisterSpaceGroup;
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%include <openbabel/obiter.h>
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