mirror of
https://github.com/openbabel/openbabel.git
synced 2025-02-25 18:55:23 -06:00
d18872df68
handle the new pluginiter.h, and in particular, its use in OBFingerprint.Iter. Also, regenerated all of the dependent files. * scripts/openbabel-python.i: Removed python code added on 2006-12-20 to set BABEL_DATADIR as it actually had no effect.
110 lines
3.0 KiB
OpenEdge ABL
110 lines
3.0 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/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/ring.h>
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#include <openbabel/obconversion.h>
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#include <openbabel/oberror.h>
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#include <openbabel/pluginiter.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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#include <openbabel/bitvec.h>
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#include <openbabel/chains.h>
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#include <openbabel/typer.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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// These methods are renamed to valid Python method names, as otherwise
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// they cannot be used from Python
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%rename(inc) *::operator++;
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%rename(good) *::operator bool;
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%rename(deref) *::operator->;
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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/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/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/pluginiter.h>
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%template (pluginiterFingerprint) OpenBabel::PluginIter<OpenBabel::OBFingerprint>;
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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/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 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 *::operator=;
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%include <openbabel/obiter.h>
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