| /dports/science/openbabel/openbabel-3.1.1/src/ |
| H A D | generic.cpp | 1022 OBAngleData::OBAngleData() in OBAngleData() function in OpenBabel::OBAngleData
1029 OBAngleData::OBAngleData(const OBAngleData &src) in OBAngleData() function in OpenBabel::OBAngleData
1036 OBAngleData& OBAngleData::operator =(const OBAngleData &src) in operator =()
1050 void OBAngleData::Clear() in Clear()
1059 void OBAngleData::SetData(OBAngle &angle) in SetData()
1070 bool OBAngleData::FillAngleArray(std::vector<std::vector<unsigned int> > &angles) in FillAngleArray()
1099 unsigned int OBAngleData::FillAngleArray(int **angles, unsigned int &size) in FillAngleArray()
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| H A D | obiter.cpp | 1117 OBAngleData *ad = (OBAngleData *) mol->GetData(OBGenericDataType::AngleData); in OBMolAngleIter()
1132 OBAngleData *ad = (OBAngleData *) mol.GetData(OBGenericDataType::AngleData); in OBMolAngleIter()
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| H A D | mol.cpp | 396 OBAngleData *angles = new OBAngleData; in FindAngles()
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| /dports/science/openbabel/openbabel-3.1.1/include/openbabel/ |
| H A D | generic.h | 700 friend class OBAngleData; variable
750 class OBAPI OBAngleData : public OBGenericData
757 OBAngleData();
758 OBAngleData(const OBAngleData &);
767 OBAngleData &operator =(const OBAngleData &);
769 {return new OBAngleData(*this);} in Clone()
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| /dports/science/openbabel/openbabel-3.1.1/scripts/ |
| H A D | openbabel-csharp.i | 193 DISABLE_DOWNCAST(OBAngleData);
449 %ignore OpenBabel::OBAngleData::FillAngleArray(int**, unsigned int&);
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| /dports/science/openbabel/openbabel-3.1.1/scripts/python/openbabel/ |
| H A D | openbabel.py | 1361 class OBAngleData(OBGenericData): class
1368 OBAngleData.Clear = new_instancemethod(_openbabel.OBAngleData_Clear, None, OBAngleData)
1369 OBAngleData.FillAngleArray = new_instancemethod(_openbabel.OBAngleData_FillAngleArray, None, OBAngl…
1370 OBAngleData.SetData = new_instancemethod(_openbabel.OBAngleData_SetData, None, OBAngleData)
1371 OBAngleData.GetSize = new_instancemethod(_openbabel.OBAngleData_GetSize, None, OBAngleData)
1373 OBAngleData_swigregister(OBAngleData)
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| H A D | openbabel-python.cpp | 7230 return (OpenBabel::OBAngleData *) data; in toAngleData()
19940 …OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; void *argp1 = 0 ; int res1 = 0 ; PyO… in _wrap_OBAngleData_Clear()
19947 …PyObject *resultobj = 0; OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; int **arg2 … in _wrap_OBAngleData_FillAngleArray__SWIG_0()
19952 arg1 = reinterpret_cast< OpenBabel::OBAngleData * >(argp1); in _wrap_OBAngleData_FillAngleArray__SWIG_0()
19963 PyObject *resultobj = 0; OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; in _wrap_OBAngleData_FillAngleArray__SWIG_1()
19968 arg1 = reinterpret_cast< OpenBabel::OBAngleData * >(argp1); in _wrap_OBAngleData_FillAngleArray__SWIG_1()
19987 …OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; OpenBabel::OBAngle *arg2 = 0 ; void … in _wrap_OBAngleData_SetData()
19992 arg1 = reinterpret_cast< OpenBabel::OBAngleData * >(argp1); in _wrap_OBAngleData_SetData()
20000 …OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; void *argp1 = 0 ; int res1 = 0 ; PyO… in _wrap_OBAngleData_GetSize()
20004 …arg1 = reinterpret_cast< OpenBabel::OBAngleData * >(argp1); result = ((OpenBabel::OBAngleData cons… in _wrap_OBAngleData_GetSize()
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| /dports/science/openbabel/openbabel-3.1.1/scripts/csharp/ |
| H A D | openbabel-csharp.cpp | 2722 SWIGINTERN OpenBabel::OBAngleData *OpenBabel_OBGenericData_ToAngleData(OpenBabel::OBGenericData *se… in OpenBabel_OBGenericData_ToAngleData()
2723 return (OpenBabel::OBAngleData *) self; in OpenBabel_OBGenericData_ToAngleData()
6617 …OpenBabel::OBGenericData *arg1 = (OpenBabel::OBGenericData *) 0 ; OpenBabel::OBAngleData *result =… in CSharp_OpenBabel_OBGenericData_ToAngleData()
7327 …OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; arg1 = (OpenBabel::OBAngleData *)jar… in CSharp_OpenBabel_OBAngleData_Clear()
7329 unsigned int jresult ; OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; in CSharp_OpenBabel_OBAngleData_FillAngleArray()
7330 …or< std::vector< unsigned int > > *arg2 = 0 ; bool result; arg1 = (OpenBabel::OBAngleData *)jarg1; in CSharp_OpenBabel_OBAngleData_FillAngleArray()
7335 OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; OpenBabel::OBAngle *arg2 = 0 ; in CSharp_OpenBabel_OBAngleData_SetData()
7336 arg1 = (OpenBabel::OBAngleData *)jarg1; arg2 = (OpenBabel::OBAngle *)jarg2; if (!arg2) { in CSharp_OpenBabel_OBAngleData_SetData()
7340 …OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; size_t result; arg1 = (OpenBabel::OB… in CSharp_OpenBabel_OBAngleData_GetSize()
7341 …result = ((OpenBabel::OBAngleData const *)arg1)->GetSize(); jresult = (unsigned long)result; retu… in CSharp_OpenBabel_OBAngleData_GetSize()
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| /dports/science/openbabel/openbabel-3.1.1/scripts/java/ |
| H A D | openbabel-java.cpp | 602 return (OpenBabel::OBAngleData *) data; in toAngleData()
1446 …result = (OpenBabel::OBAngleData *)toAngleData(arg1); *(OpenBabel::OBAngleData **)&jresult = resul… in Java_org_openbabel_openbabel_1javaJNI_toAngleData()
3404 …OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; (void)jenv; (void)jcls; (void)jarg1_; in Java_org_openbabel_openbabel_1javaJNI_OBAngleData_1Clear()
3405 arg1 = *(OpenBabel::OBAngleData **)&jarg1; (arg1)->Clear(); } in Java_org_openbabel_openbabel_1javaJNI_OBAngleData_1Clear()
3407 …jlong jresult = 0 ; OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; int **arg2 = (in… in Java_org_openbabel_openbabel_1javaJNI_OBAngleData_1FillAngleArray_1_1SWIG_10()
3413 jboolean jresult = 0 ; OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; in Java_org_openbabel_openbabel_1javaJNI_OBAngleData_1FillAngleArray_1_1SWIG_11()
3419 …OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; OpenBabel::OBAngle *arg2 = 0 ; (void… in Java_org_openbabel_openbabel_1javaJNI_OBAngleData_1SetData()
3424 …jlong jresult = 0 ; OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; size_t result; (… in Java_org_openbabel_openbabel_1javaJNI_OBAngleData_1GetSize()
3425 …(void)jarg1_; arg1 = *(OpenBabel::OBAngleData **)&jarg1; result = ((OpenBabel::OBAngleData const … in Java_org_openbabel_openbabel_1javaJNI_OBAngleData_1GetSize()
3428 OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; (void)jenv; (void)jcls; in Java_org_openbabel_openbabel_1javaJNI_delete_1OBAngleData()
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| /dports/science/openbabel/openbabel-3.1.1/scripts/perl/ |
| H A D | openbabel-perl.cpp | 2373 return (OpenBabel::OBAngleData *) data; in toAngleData()
9300 XS(_wrap_OBAngleData_Clear) { { OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; void … in XS()
9306 …rap_OBAngleData_FillAngleArray__SWIG_0) { { OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData… in XS()
9312 arg1 = reinterpret_cast< OpenBabel::OBAngleData * >(argp1); in XS()
9323 …rap_OBAngleData_FillAngleArray__SWIG_1) { { OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData… in XS()
9329 arg1 = reinterpret_cast< OpenBabel::OBAngleData * >(argp1); in XS()
9356 XS(_wrap_OBAngleData_SetData) { { OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; Ope… in XS()
9361 arg1 = reinterpret_cast< OpenBabel::OBAngleData * >(argp1); in XS()
9368 XS(_wrap_OBAngleData_GetSize) { { OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; voi… in XS()
9372 …arg1 = reinterpret_cast< OpenBabel::OBAngleData * >(argp1); result = ((OpenBabel::OBAngleData cons… in XS()
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| H A D | OpenBabel.pm | 1735 package Chemistry::OpenBabel::OBAngleData;
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| /dports/science/openbabel/openbabel-3.1.1/scripts/R/examples/openbabelR/src/ |
| H A D | openbabel-R.cpp | 3367 return (OpenBabel::OBAngleData *) data; in toAngleData()
10894 …EXP R_swig_OBAngleData_Clear ( SEXP self) { OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData… in R_swig_OBAngleData_Clear()
10901 …unsigned int result; OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; int **arg2 = (i… in R_swig_OBAngleData_FillAngleArray__SWIG_0()
10906 arg1 = reinterpret_cast< OpenBabel::OBAngleData * >(argp1); in R_swig_OBAngleData_FillAngleArray__SWIG_0()
10917 OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; in R_swig_OBAngleData_FillAngleArray__SWIG_1()
10923 arg1 = reinterpret_cast< OpenBabel::OBAngleData * >(argp1); in R_swig_OBAngleData_FillAngleArray__SWIG_1()
10934 …OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; OpenBabel::OBAngle *arg2 = 0 ; void … in R_swig_OBAngleData_SetData()
10938 arg1 = reinterpret_cast< OpenBabel::OBAngleData * >(argp1); in R_swig_OBAngleData_SetData()
10946 …OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; void *argp1 = 0 ; int res1 = 0 ; uns… in R_swig_OBAngleData_GetSize()
10950 …arg1 = reinterpret_cast< OpenBabel::OBAngleData * >(argp1); result = ((OpenBabel::OBAngleData cons… in R_swig_OBAngleData_GetSize()
[all …]
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| /dports/science/openbabel/openbabel-3.1.1/scripts/ruby/ |
| H A D | openbabel-ruby.cpp | 8119 return (OpenBabel::OBAngleData *) data; in toAngleData()
19969 …OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; void *argp1 = 0 ; int res1 = 0 ; if … in _wrap_OBAngleData_clear()
19975 …OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; int **arg2 = (int **) 0 ; unsigned i… in _wrap_OBAngleData_fill_angle_array__SWIG_0()
19981 arg1 = reinterpret_cast< OpenBabel::OBAngleData * >(argp1); in _wrap_OBAngleData_fill_angle_array__SWIG_0()
19992 OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; in _wrap_OBAngleData_fill_angle_array__SWIG_1()
19998 arg1 = reinterpret_cast< OpenBabel::OBAngleData * >(argp1); in _wrap_OBAngleData_fill_angle_array__SWIG_1()
20017 …OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; OpenBabel::OBAngle *arg2 = 0 ; void … in _wrap_OBAngleData_set_data()
20022 arg1 = reinterpret_cast< OpenBabel::OBAngleData * >(argp1); in _wrap_OBAngleData_set_data()
20029 …OpenBabel::OBAngleData *arg1 = (OpenBabel::OBAngleData *) 0 ; void *argp1 = 0 ; int res1 = 0 ; siz… in _wrap_OBAngleData_get_size()
20034 …arg1 = reinterpret_cast< OpenBabel::OBAngleData * >(argp1); result = ((OpenBabel::OBAngleData cons… in _wrap_OBAngleData_get_size()
[all …]
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