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Searched refs:GetIntensities (Results 1 – 10 of 10) sorted by relevance

/dports/science/openbabel/openbabel-3.1.1/src/formats/
H A Dmoldenformat.cpp389 vector<double> intensities = vib->GetIntensities(); in WriteMolecule()
/dports/science/openbabel/openbabel-3.1.1/include/openbabel/
H A Dgeneric.h849 std::vector<double> GetIntensities() const in GetIntensities() function
/dports/science/openbabel/openbabel-3.1.1/scripts/perl/
H A DOpenBabel.pm1834 *GetIntensities = *Chemistry::OpenBabelc::OBVibrationData_GetIntensities;
H A Dopenbabel-perl.cpp9580 …result = ((OpenBabel::OBVibrationData const *)arg1)->GetIntensities(); { size_t len = (&result)->s… in XS()
/dports/science/openbabel/openbabel-3.1.1/scripts/python/openbabel/
H A Dopenbabel.py1397 OBVibrationData.GetIntensities = new_instancemethod(_openbabel.OBVibrationData_GetIntensities, None…
H A Dopenbabel-python.cpp20201 result = ((OpenBabel::OBVibrationData const *)arg1)->GetIntensities(); in _wrap_OBVibrationData_GetIntensities()
/dports/science/openbabel/openbabel-3.1.1/scripts/csharp/
H A Dopenbabel-csharp.cpp7406 …l::OBVibrationData *)jarg1; result = ((OpenBabel::OBVibrationData const *)arg1)->GetIntensities(); in CSharp_OpenBabel_OBVibrationData_GetIntensities()
/dports/science/openbabel/openbabel-3.1.1/scripts/java/
H A Dopenbabel-java.cpp3503 result = ((OpenBabel::OBVibrationData const *)arg1)->GetIntensities(); in Java_org_openbabel_openbabel_1javaJNI_OBVibrationData_1GetIntensities()
/dports/science/openbabel/openbabel-3.1.1/scripts/R/examples/openbabelR/src/
H A Dopenbabel-R.cpp11192 result = ((OpenBabel::OBVibrationData const *)arg1)->GetIntensities(); in R_swig_OBVibrationData_GetIntensities()
/dports/science/openbabel/openbabel-3.1.1/scripts/ruby/
H A Dopenbabel-ruby.cpp20231 result = ((OpenBabel::OBVibrationData const *)arg1)->GetIntensities(); in _wrap_OBVibrationData_get_intensities()