| /dports/math/vtk8/VTK-8.2.0/Domains/Chemistry/ |
| H A D | vtkPeriodicTable.cxx | 185 float vtkPeriodicTable::GetVDWRadius(unsigned short atomicNum) in GetVDWRadius() function in vtkPeriodicTable
202 maxRadius = std::max(maxRadius, this->GetVDWRadius(i)); in GetMaxVDWRadius()
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| H A D | vtkPeriodicTable.h | 87 float GetVDWRadius(unsigned short atomicNum);
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| H A D | vtkMoleculeToAtomBallFilter.cxx | 101 scaledRadius = this->RadiusScale * pTab->GetVDWRadius(atomicNum); in RequestData()
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| H A D | vtkProteinRibbonFilter.cxx | 179 pTab->GetVDWRadius(atomicNum), 1.f); in RequestData()
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| H A D | vtkMoleculeMapper.cxx | 443 this->PeriodicTable->GetVDWRadius(atomicNbWithoutGhostArray->GetValue(i))); in UpdateAtomGlyphPolyData()
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| /dports/math/vtk9/VTK-9.1.0/Domains/Chemistry/ |
| H A D | vtkPeriodicTable.cxx | 175 float vtkPeriodicTable::GetVDWRadius(unsigned short atomicNum) in GetVDWRadius() function in vtkPeriodicTable
192 maxRadius = std::max(maxRadius, this->GetVDWRadius(i)); in GetMaxVDWRadius()
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| H A D | vtkPeriodicTable.h | 87 float GetVDWRadius(unsigned short atomicNum);
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| H A D | vtkMoleculeToAtomBallFilter.cxx | 97 scaledRadius = this->RadiusScale * pTab->GetVDWRadius(atomicNum); in RequestData()
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| H A D | vtkProteinRibbonFilter.cxx | 176 ToColor3ubFromColor3f(pTab->GetDefaultRGBTuple(atomicNum)), pTab->GetVDWRadius(atomicNum), in RequestData()
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| H A D | vtkMoleculeMapper.cxx | 464 this->PeriodicTable->GetVDWRadius(atomicNbWithoutGhostArray->GetValue(i))); in UpdateAtomGlyphPolyData()
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| /dports/math/vtk6/VTK-6.2.0/Domains/Chemistry/ |
| H A D | vtkPeriodicTable.h | 73 float GetVDWRadius(const unsigned short atomicNum);
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| H A D | vtkPeriodicTable.cxx | 172 float vtkPeriodicTable::GetVDWRadius(const unsigned short atomicNum) in GetVDWRadius() function in vtkPeriodicTable
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| H A D | vtkMoleculeToAtomBallFilter.cxx | 101 scaledRadius = this->RadiusScale * pTab->GetVDWRadius(atomicNum); in RequestData()
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| H A D | vtkProteinRibbonFilter.cxx | 181 pTab->GetVDWRadius(atomicNum), 1.f); in RequestData()
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| H A D | vtkMoleculeMapper.cxx | 362 this->PeriodicTable->GetVDWRadius(atomicNums->GetValue(i))); in UpdateAtomGlyphPolyData()
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| /dports/science/libghemical/libghemical-3.0.0/src/ |
| H A D | atom.cpp | 231 fGL element::GetVDWRadius(void) const in GetVDWRadius() function in element
293 vdwr = el.GetVDWRadius(); in atom()
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| H A D | pop_ana.cpp | 76 const fGL r1 = (* it1).el.GetVDWRadius(); in DoPopAna()
129 const fGL r5 = (* it5).el.GetVDWRadius(); in DoPopAna()
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| H A D | atom.h | 81 fGL GetVDWRadius(void) const;
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| H A D | eng1_sf.cpp | 851 (* it1).vdwr = (* it1).el.GetVDWRadius(); in ~setup1_sf()
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| /dports/math/vtk9/VTK-9.1.0/Domains/Chemistry/Testing/Cxx/ |
| H A D | TestPeriodicTable.cxx | 149 radius = pTab->GetVDWRadius(56); in TestPeriodicTable()
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| /dports/math/vtk6/VTK-6.2.0/Domains/Chemistry/Testing/Cxx/ |
| H A D | TestPeriodicTable.cxx | 161 radius = pTab->GetVDWRadius(56); in TestPeriodicTable()
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| /dports/math/vtk8/VTK-8.2.0/Domains/Chemistry/Testing/Cxx/ |
| H A D | TestPeriodicTable.cxx | 161 radius = pTab->GetVDWRadius(56); in TestPeriodicTable()
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| /dports/math/vtk9/VTK-9.1.0/IO/Chemistry/ |
| H A D | vtkMoleculeReaderBase.cxx | 279 double radius = this->PeriodicTable->GetVDWRadius(AtomType->GetValue(i)); in ReadMolecule()
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| /dports/math/vtk9/VTK-9.1.0/Rendering/RayTracing/ |
| H A D | vtkOSPRayMoleculeMapperNode.cxx | 158 mapper->GetPeriodicTable()->GetVDWRadius(atomicNumbers->GetValue(i))); in Render()
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| /dports/science/ghemical/ghemical-3.0.0/src/ |
| H A D | project.cpp | 3162 draw_data[0]->vdwr = element::current_element.GetVDWRadius(); // also need to update these... in DrawEvent()
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