// python wrapper for vtkAbstractElectronicData // #define VTK_WRAPPING_CXX #define VTK_STREAMS_FWD_ONLY #include "vtkPythonArgs.h" #include "vtkPythonOverload.h" #include "vtkConfigure.h" #include #include #include "vtkVariant.h" #include "vtkIndent.h" #include "vtkAbstractElectronicData.h" extern "C" { VTK_ABI_EXPORT void PyVTKAddFile_vtkAbstractElectronicData(PyObject *); } extern "C" { VTK_ABI_EXPORT PyObject *PyvtkAbstractElectronicData_ClassNew(); } #ifndef DECLARED_PyvtkDataObject_ClassNew extern "C" { PyObject *PyvtkDataObject_ClassNew(); } #define DECLARED_PyvtkDataObject_ClassNew #endif static const char *PyvtkAbstractElectronicData_Doc = "vtkAbstractElectronicData - Provides access to and storage of\nchemical electronic data\n\n" "Superclass: vtkDataObject\n\n" ; static PyObject * PyvtkAbstractElectronicData_IsTypeOf(PyObject *, PyObject *args) { vtkPythonArgs ap(args, "IsTypeOf"); char *temp0 = nullptr; PyObject *result = nullptr; if (ap.CheckArgCount(1) && ap.GetValue(temp0)) { int tempr = vtkAbstractElectronicData::IsTypeOf(temp0); if (!ap.ErrorOccurred()) { result = ap.BuildValue(tempr); } } return result; } static PyObject * PyvtkAbstractElectronicData_IsA(PyObject *self, PyObject *args) { vtkPythonArgs ap(self, args, "IsA"); vtkObjectBase *vp = ap.GetSelfPointer(self, args); vtkAbstractElectronicData *op = static_cast(vp); char *temp0 = nullptr; PyObject *result = nullptr; if (op && ap.CheckArgCount(1) && ap.GetValue(temp0)) { int tempr = (ap.IsBound() ? op->IsA(temp0) : op->vtkAbstractElectronicData::IsA(temp0)); if (!ap.ErrorOccurred()) { result = ap.BuildValue(tempr); } } return result; } static PyObject * PyvtkAbstractElectronicData_SafeDownCast(PyObject *, PyObject *args) { vtkPythonArgs ap(args, "SafeDownCast"); vtkObjectBase *temp0 = nullptr; PyObject *result = nullptr; if (ap.CheckArgCount(1) && ap.GetVTKObject(temp0, "vtkObjectBase")) { vtkAbstractElectronicData *tempr = vtkAbstractElectronicData::SafeDownCast(temp0); if (!ap.ErrorOccurred()) { result = ap.BuildVTKObject(tempr); } } return result; } static PyObject * PyvtkAbstractElectronicData_NewInstance(PyObject *self, PyObject *args) { vtkPythonArgs ap(self, args, "NewInstance"); vtkObjectBase *vp = ap.GetSelfPointer(self, args); vtkAbstractElectronicData *op = static_cast(vp); PyObject *result = nullptr; if (op && ap.CheckArgCount(0)) { vtkAbstractElectronicData *tempr = (ap.IsBound() ? op->NewInstance() : op->vtkAbstractElectronicData::NewInstance()); if (!ap.ErrorOccurred()) { result = ap.BuildVTKObject(tempr); if (result && PyVTKObject_Check(result)) { PyVTKObject_GetObject(result)->UnRegister(0); PyVTKObject_SetFlag(result, VTK_PYTHON_IGNORE_UNREGISTER, 1); } } } return result; } static PyObject * PyvtkAbstractElectronicData_GetNumberOfMOs(PyObject *self, PyObject *args) { vtkPythonArgs ap(self, args, "GetNumberOfMOs"); vtkObjectBase *vp = ap.GetSelfPointer(self, args); vtkAbstractElectronicData *op = static_cast(vp); PyObject *result = nullptr; if (op && !ap.IsPureVirtual() && ap.CheckArgCount(0)) { vtkIdType tempr = op->GetNumberOfMOs(); if (!ap.ErrorOccurred()) { result = ap.BuildValue(tempr); } } return result; } static PyObject * PyvtkAbstractElectronicData_GetNumberOfElectrons(PyObject *self, PyObject *args) { vtkPythonArgs ap(self, args, "GetNumberOfElectrons"); vtkObjectBase *vp = ap.GetSelfPointer(self, args); vtkAbstractElectronicData *op = static_cast(vp); PyObject *result = nullptr; if (op && !ap.IsPureVirtual() && ap.CheckArgCount(0)) { vtkIdType tempr = op->GetNumberOfElectrons(); if (!ap.ErrorOccurred()) { result = ap.BuildValue(tempr); } } return result; } static PyObject * PyvtkAbstractElectronicData_GetMO(PyObject *self, PyObject *args) { vtkPythonArgs ap(self, args, "GetMO"); vtkObjectBase *vp = ap.GetSelfPointer(self, args); vtkAbstractElectronicData *op = static_cast(vp); vtkIdType temp0; PyObject *result = nullptr; if (op && !ap.IsPureVirtual() && ap.CheckArgCount(1) && ap.GetValue(temp0)) { vtkImageData *tempr = op->GetMO(temp0); if (!ap.ErrorOccurred()) { result = ap.BuildVTKObject(tempr); } } return result; } static PyObject * PyvtkAbstractElectronicData_GetElectronDensity(PyObject *self, PyObject *args) { vtkPythonArgs ap(self, args, "GetElectronDensity"); vtkObjectBase *vp = ap.GetSelfPointer(self, args); vtkAbstractElectronicData *op = static_cast(vp); PyObject *result = nullptr; if (op && !ap.IsPureVirtual() && ap.CheckArgCount(0)) { vtkImageData *tempr = op->GetElectronDensity(); if (!ap.ErrorOccurred()) { result = ap.BuildVTKObject(tempr); } } return result; } static PyObject * PyvtkAbstractElectronicData_GetHOMO(PyObject *self, PyObject *args) { vtkPythonArgs ap(self, args, "GetHOMO"); vtkObjectBase *vp = ap.GetSelfPointer(self, args); vtkAbstractElectronicData *op = static_cast(vp); PyObject *result = nullptr; if (op && ap.CheckArgCount(0)) { vtkImageData *tempr = (ap.IsBound() ? op->GetHOMO() : op->vtkAbstractElectronicData::GetHOMO()); if (!ap.ErrorOccurred()) { result = ap.BuildVTKObject(tempr); } } return result; } static PyObject * PyvtkAbstractElectronicData_GetLUMO(PyObject *self, PyObject *args) { vtkPythonArgs ap(self, args, "GetLUMO"); vtkObjectBase *vp = ap.GetSelfPointer(self, args); vtkAbstractElectronicData *op = static_cast(vp); PyObject *result = nullptr; if (op && ap.CheckArgCount(0)) { vtkImageData *tempr = (ap.IsBound() ? op->GetLUMO() : op->vtkAbstractElectronicData::GetLUMO()); if (!ap.ErrorOccurred()) { result = ap.BuildVTKObject(tempr); } } return result; } static PyObject * PyvtkAbstractElectronicData_GetHOMOOrbitalNumber(PyObject *self, PyObject *args) { vtkPythonArgs ap(self, args, "GetHOMOOrbitalNumber"); vtkObjectBase *vp = ap.GetSelfPointer(self, args); vtkAbstractElectronicData *op = static_cast(vp); PyObject *result = nullptr; if (op && ap.CheckArgCount(0)) { vtkIdType tempr = (ap.IsBound() ? op->GetHOMOOrbitalNumber() : op->vtkAbstractElectronicData::GetHOMOOrbitalNumber()); if (!ap.ErrorOccurred()) { result = ap.BuildValue(tempr); } } return result; } static PyObject * PyvtkAbstractElectronicData_GetLUMOOrbitalNumber(PyObject *self, PyObject *args) { vtkPythonArgs ap(self, args, "GetLUMOOrbitalNumber"); vtkObjectBase *vp = ap.GetSelfPointer(self, args); vtkAbstractElectronicData *op = static_cast(vp); PyObject *result = nullptr; if (op && ap.CheckArgCount(0)) { vtkIdType tempr = (ap.IsBound() ? op->GetLUMOOrbitalNumber() : op->vtkAbstractElectronicData::GetLUMOOrbitalNumber()); if (!ap.ErrorOccurred()) { result = ap.BuildValue(tempr); } } return result; } static PyObject * PyvtkAbstractElectronicData_IsHOMO(PyObject *self, PyObject *args) { vtkPythonArgs ap(self, args, "IsHOMO"); vtkObjectBase *vp = ap.GetSelfPointer(self, args); vtkAbstractElectronicData *op = static_cast(vp); vtkIdType temp0; PyObject *result = nullptr; if (op && ap.CheckArgCount(1) && ap.GetValue(temp0)) { bool tempr = (ap.IsBound() ? op->IsHOMO(temp0) : op->vtkAbstractElectronicData::IsHOMO(temp0)); if (!ap.ErrorOccurred()) { result = ap.BuildValue(tempr); } } return result; } static PyObject * PyvtkAbstractElectronicData_IsLUMO(PyObject *self, PyObject *args) { vtkPythonArgs ap(self, args, "IsLUMO"); vtkObjectBase *vp = ap.GetSelfPointer(self, args); vtkAbstractElectronicData *op = static_cast(vp); vtkIdType temp0; PyObject *result = nullptr; if (op && ap.CheckArgCount(1) && ap.GetValue(temp0)) { bool tempr = (ap.IsBound() ? op->IsLUMO(temp0) : op->vtkAbstractElectronicData::IsLUMO(temp0)); if (!ap.ErrorOccurred()) { result = ap.BuildValue(tempr); } } return result; } static PyObject * PyvtkAbstractElectronicData_DeepCopy(PyObject *self, PyObject *args) { vtkPythonArgs ap(self, args, "DeepCopy"); vtkObjectBase *vp = ap.GetSelfPointer(self, args); vtkAbstractElectronicData *op = static_cast(vp); vtkDataObject *temp0 = nullptr; PyObject *result = nullptr; if (op && ap.CheckArgCount(1) && ap.GetVTKObject(temp0, "vtkDataObject")) { if (ap.IsBound()) { op->DeepCopy(temp0); } else { op->vtkAbstractElectronicData::DeepCopy(temp0); } if (!ap.ErrorOccurred()) { result = ap.BuildNone(); } } return result; } static PyObject * PyvtkAbstractElectronicData_GetPadding(PyObject *self, PyObject *args) { vtkPythonArgs ap(self, args, "GetPadding"); vtkObjectBase *vp = ap.GetSelfPointer(self, args); vtkAbstractElectronicData *op = static_cast(vp); PyObject *result = nullptr; if (op && ap.CheckArgCount(0)) { double tempr = (ap.IsBound() ? op->GetPadding() : op->vtkAbstractElectronicData::GetPadding()); if (!ap.ErrorOccurred()) { result = ap.BuildValue(tempr); } } return result; } static PyMethodDef PyvtkAbstractElectronicData_Methods[] = { {"IsTypeOf", PyvtkAbstractElectronicData_IsTypeOf, METH_VARARGS, "V.IsTypeOf(string) -> int\nC++: static vtkTypeBool IsTypeOf(const char *type)\n\nReturn 1 if this class type is the same type of (or a subclass\nof) the named class. Returns 0 otherwise. This method works in\ncombination with vtkTypeMacro found in vtkSetGet.h.\n"}, {"IsA", PyvtkAbstractElectronicData_IsA, METH_VARARGS, "V.IsA(string) -> int\nC++: vtkTypeBool IsA(const char *type) override;\n\nReturn 1 if this class is the same type of (or a subclass of) the\nnamed class. Returns 0 otherwise. This method works in\ncombination with vtkTypeMacro found in vtkSetGet.h.\n"}, {"SafeDownCast", PyvtkAbstractElectronicData_SafeDownCast, METH_VARARGS, "V.SafeDownCast(vtkObjectBase) -> vtkAbstractElectronicData\nC++: static vtkAbstractElectronicData *SafeDownCast(\n vtkObjectBase *o)\n\n"}, {"NewInstance", PyvtkAbstractElectronicData_NewInstance, METH_VARARGS, "V.NewInstance() -> vtkAbstractElectronicData\nC++: vtkAbstractElectronicData *NewInstance()\n\n"}, {"GetNumberOfMOs", PyvtkAbstractElectronicData_GetNumberOfMOs, METH_VARARGS, "V.GetNumberOfMOs() -> int\nC++: virtual vtkIdType GetNumberOfMOs()\n\nReturns the number of molecular orbitals available.\n"}, {"GetNumberOfElectrons", PyvtkAbstractElectronicData_GetNumberOfElectrons, METH_VARARGS, "V.GetNumberOfElectrons() -> int\nC++: virtual vtkIdType GetNumberOfElectrons()\n\nReturns the number of electrons in the molecule.\n"}, {"GetMO", PyvtkAbstractElectronicData_GetMO, METH_VARARGS, "V.GetMO(int) -> vtkImageData\nC++: virtual vtkImageData *GetMO(vtkIdType orbitalNumber)\n\nReturns the vtkImageData for the requested molecular orbital.\n"}, {"GetElectronDensity", PyvtkAbstractElectronicData_GetElectronDensity, METH_VARARGS, "V.GetElectronDensity() -> vtkImageData\nC++: virtual vtkImageData *GetElectronDensity()\n\nReturns vtkImageData for the molecule's electron density. The\ndata will be calculated when first requested, and cached for\nlater requests.\n"}, {"GetHOMO", PyvtkAbstractElectronicData_GetHOMO, METH_VARARGS, "V.GetHOMO() -> vtkImageData\nC++: vtkImageData *GetHOMO()\n\nReturns vtkImageData for the Highest Occupied Molecular Orbital.\n"}, {"GetLUMO", PyvtkAbstractElectronicData_GetLUMO, METH_VARARGS, "V.GetLUMO() -> vtkImageData\nC++: vtkImageData *GetLUMO()\n\nReturns vtkImageData for the Lowest Unoccupied Molecular Orbital.\n"}, {"GetHOMOOrbitalNumber", PyvtkAbstractElectronicData_GetHOMOOrbitalNumber, METH_VARARGS, "V.GetHOMOOrbitalNumber() -> int\nC++: vtkIdType GetHOMOOrbitalNumber()\n\n"}, {"GetLUMOOrbitalNumber", PyvtkAbstractElectronicData_GetLUMOOrbitalNumber, METH_VARARGS, "V.GetLUMOOrbitalNumber() -> int\nC++: vtkIdType GetLUMOOrbitalNumber()\n\n"}, {"IsHOMO", PyvtkAbstractElectronicData_IsHOMO, METH_VARARGS, "V.IsHOMO(int) -> bool\nC++: bool IsHOMO(vtkIdType orbitalNumber)\n\nReturns true if the given orbital number is the Highest Occupied\nMolecular Orbital, false otherwise.\n"}, {"IsLUMO", PyvtkAbstractElectronicData_IsLUMO, METH_VARARGS, "V.IsLUMO(int) -> bool\nC++: bool IsLUMO(vtkIdType orbitalNumber)\n\nReturns true if the given orbital number is the Lowest Unoccupied\nMolecular Orbital, false otherwise.\n"}, {"DeepCopy", PyvtkAbstractElectronicData_DeepCopy, METH_VARARGS, "V.DeepCopy(vtkDataObject)\nC++: void DeepCopy(vtkDataObject *obj) override;\n\nDeep copies the data object into this.\n"}, {"GetPadding", PyvtkAbstractElectronicData_GetPadding, METH_VARARGS, "V.GetPadding() -> float\nC++: virtual double GetPadding()\n\nGet the padding between the molecule and the cube boundaries.\nThis is used to determine the dataset's bounds.\n"}, {nullptr, nullptr, 0, nullptr} }; static PyTypeObject PyvtkAbstractElectronicData_Type = { PyVarObject_HEAD_INIT(&PyType_Type, 0) "vtkCommonDataModelPython.vtkAbstractElectronicData", // tp_name sizeof(PyVTKObject), // tp_basicsize 0, // tp_itemsize PyVTKObject_Delete, // tp_dealloc 0, // tp_print nullptr, // tp_getattr nullptr, // tp_setattr nullptr, // tp_compare PyVTKObject_Repr, // tp_repr nullptr, // tp_as_number nullptr, // tp_as_sequence nullptr, // tp_as_mapping nullptr, // tp_hash nullptr, // tp_call PyVTKObject_String, // tp_str PyObject_GenericGetAttr, // tp_getattro PyObject_GenericSetAttr, // tp_setattro &PyVTKObject_AsBuffer, // tp_as_buffer Py_TPFLAGS_DEFAULT|Py_TPFLAGS_HAVE_GC|Py_TPFLAGS_BASETYPE, // tp_flags PyvtkAbstractElectronicData_Doc, // tp_doc PyVTKObject_Traverse, // tp_traverse nullptr, // tp_clear nullptr, // tp_richcompare offsetof(PyVTKObject, vtk_weakreflist), // tp_weaklistoffset nullptr, // tp_iter nullptr, // tp_iternext nullptr, // tp_methods nullptr, // tp_members PyVTKObject_GetSet, // tp_getset nullptr, // tp_base nullptr, // tp_dict nullptr, // tp_descr_get nullptr, // tp_descr_set offsetof(PyVTKObject, vtk_dict), // tp_dictoffset nullptr, // tp_init nullptr, // tp_alloc PyVTKObject_New, // tp_new PyObject_GC_Del, // tp_free nullptr, // tp_is_gc nullptr, // tp_bases nullptr, // tp_mro nullptr, // tp_cache nullptr, // tp_subclasses nullptr, // tp_weaklist VTK_WRAP_PYTHON_SUPPRESS_UNINITIALIZED }; PyObject *PyvtkAbstractElectronicData_ClassNew() { PyVTKClass_Add( &PyvtkAbstractElectronicData_Type, PyvtkAbstractElectronicData_Methods, "vtkAbstractElectronicData", nullptr); PyTypeObject *pytype = &PyvtkAbstractElectronicData_Type; if ((pytype->tp_flags & Py_TPFLAGS_READY) != 0) { return (PyObject *)pytype; } #if !defined(VTK_PY3K) && PY_VERSION_HEX >= 0x02060000 pytype->tp_flags |= Py_TPFLAGS_HAVE_NEWBUFFER; #endif pytype->tp_base = (PyTypeObject *)PyvtkDataObject_ClassNew(); PyType_Ready(pytype); return (PyObject *)pytype; } void PyVTKAddFile_vtkAbstractElectronicData( PyObject *dict) { PyObject *o; o = PyvtkAbstractElectronicData_ClassNew(); if (o && PyDict_SetItemString(dict, "vtkAbstractElectronicData", o) != 0) { Py_DECREF(o); } }