Clipper
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fractional reciprocal coordinate (i.e. non-integer hkl) More...
#include <coords.h>
Public Member Functions | |
Coord_reci_frac () | |
null constructor | |
Coord_reci_frac (const Vec3<> &v) | |
constructor: copy/convert | |
Coord_reci_frac (const ftype &us, const ftype &vs, const ftype &ws) | |
constructor: from u,v,w | |
Coord_reci_frac (const HKL &hkl) | |
constructor: from HKL | |
HKL | hkl () const |
round to HKL | |
ftype | invresolsq (const Cell &cell) const |
return inverse resolution squared for this reflection in given cell More... | |
const ftype & | us () const |
get u* | |
const ftype & | vs () const |
get v* | |
const ftype & | ws () const |
get w* | |
Coord_reci_orth | coord_reci_orth (const Cell &cell) const |
fractional-orthogonal reciprocal space coordinate conversion More... | |
Coord_reci_frac | transform (const RTop_frac &op) const |
return transformed coordinate | |
String | format () const |
return formatted String representation More... | |
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Vec3 () | |
null constructor | |
Vec3 (const T &v0, const T &v1, const T &v2) | |
constructor: from individual values | |
Vec3 (const Vec3< TT > &v) | |
constructor: copy/convert | |
bool | equals (const Vec3< T > &v, const T &tol) const |
test equality | |
const T & | operator[] (const int &i) const |
get element | |
T & | operator[] (const int &i) |
set element | |
Vec3< T > | unit () const |
return unit vector with same direction as this vector | |
bool | is_null () const |
test for null vector | |
String | format () const |
return formatted String representation | |
const Vec3< T > & | operator+= (const Vec3< T > &v) |
add another vector to this one | |
const Vec3< T > & | operator-= (const Vec3< T > &v) |
subtract another vector from this one | |
Additional Inherited Members | |
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static Vec3< T > | zero () |
return zero vector | |
static Vec3< T > | null () |
return null vector (only valid for floating point types) | |
static T | dot (const Vec3< T > &v1, const Vec3< T > &v2) |
Vector dot product (equivalent to *) | |
static Vec3< T > | cross (const Vec3< T > &v1, const Vec3< T > &v2) |
Vector cross product. | |
fractional reciprocal coordinate (i.e. non-integer hkl)
return inverse resolution squared for this reflection in given cell
cell | The cell concerned |
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inline |
fractional-orthogonal reciprocal space coordinate conversion
cell | The cell concerned |
String clipper::Coord_reci_frac::format | ( | ) | const |
return formatted String representation