26 #ifndef vtkPeriodicTable_h 27 #define vtkPeriodicTable_h 29 #include "vtkDomainsChemistryModule.h" 56 unsigned short GetNumberOfElements();
62 const char * GetSymbol(
unsigned short atomicNum);
67 const char * GetElementName(
unsigned short atomicNum);
75 unsigned short GetAtomicNumber(
const char *str);
81 float GetCovalentRadius(
unsigned short atomicNum);
87 float GetVDWRadius(
unsigned short atomicNum);
93 float GetMaxVDWRadius();
105 void GetDefaultRGBTuple(
unsigned short atomicNum,
float rgb[3]);
111 vtkColor3f GetDefaultRGBTuple(
unsigned short atomicNum);
Wrapper around std::string to keep symbols short.
Access to information about the elements.
static vtkNew< vtkBlueObeliskData > BlueObeliskData
abstract base class for most VTK objects
void PrintSelf(ostream &os, vtkIndent indent) override
Methods invoked by print to print information about the object including superclasses.
map scalar values into colors via a lookup table
a simple class to control print indentation
static vtkObject * New()
Create an object with Debug turned off, modified time initialized to zero, and reference counting on.
Contains chemical data from the Blue Obelisk Data Repository.