IRA/SOFI result for one cage. More...
#include <cage_enum.hpp>
Public Attributes | |
| int | nVertices = 0 |
| int | status = 1 |
| double | rmsd = -1.0 |
| std::string | pointGroup |
IRA/SOFI result for one cage.
status 0 means the library ran on these vertices. status 1 means it is absent or the cloud is empty. nVertices is the cage, not the frame.
Definition at line 86 of file cage_enum.hpp.
| int cage::CageShape::nVertices = 0 |
Definition at line 87 of file cage_enum.hpp.
| std::string cage::CageShape::pointGroup |
Definition at line 90 of file cage_enum.hpp.
| double cage::CageShape::rmsd = -1.0 |
Definition at line 89 of file cage_enum.hpp.
| int cage::CageShape::status = 1 |
Definition at line 88 of file cage_enum.hpp.