#include <coords.h>
Public Member Functions | |
Coord_frac () | |
null constructor | |
Coord_frac (const Vec3<> &v) | |
constructor: copy/convert | |
Coord_frac (const ftype &u, const ftype &v, const ftype &w) | |
constructor: from u,v,w | |
const ftype & | u () const |
get u | |
const ftype & | v () const |
get v | |
const ftype & | w () const |
get w | |
ftype | lengthsq (const Cell &cell) const |
return square of length of vector in Angstroms | |
Coord_orth | coord_orth (const Cell &cell) const |
fractional-orthogonal coordinate conversion | |
Coord_map | coord_map (const Grid &g) const |
fractional-grid coordinate conversion | |
Coord_grid | coord_grid (const Grid &g) const |
fractional-grid coordinate conversion | |
Coord_frac | transform (const RTop_frac &op) const |
return transformed coordinate | |
Coord_frac | lattice_copy_zero () const |
return lattice copy nearest origin | |
Coord_frac | lattice_copy_unit () const |
return lattice copy in unit box (0...1,0...1,0...1) | |
Coord_frac | lattice_copy_near (const Coord_frac &n) const |
return lattice copy near the specified coordinate | |
Coord_frac | symmetry_copy_near (const Spacegroup &spgr, const Cell &cell, const Coord_frac &n) const |
return symmetry copy near the specified coordinate | |
String | format () const |
return formatted String representation | |
Friends | |
Coord_frac | operator- (const Coord_frac &u1) |
Coord_frac | operator+ (const Coord_frac &u1, const Coord_frac &u2) |
Coord_frac | operator- (const Coord_frac &u1, const Coord_frac &u2) |
Coord_frac | operator* (const ftype &s, const Coord_frac &u1) |
Coord_frac | operator* (const RTop_frac &op, const Coord_frac &x1) |
return square of length of vector in Angstroms
Coord_orth clipper::Coord_frac::coord_orth | ( | const Cell & | cell | ) | const [inline] |
fractional-orthogonal coordinate conversion
cell | The cell concerned |
fractional-grid coordinate conversion
g | The grid concerned |
Coord_grid clipper::Coord_frac::coord_grid | ( | const Grid & | g | ) | const [inline] |
fractional-grid coordinate conversion
g | The grid concerned |
String clipper::Coord_frac::format | ( | ) | const |
return formatted String representation
Reimplemented from clipper::Vec3<>.