diff options
author | Thomas White <taw@physics.org> | 2011-11-15 12:17:59 +0100 |
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committer | Thomas White <taw@physics.org> | 2012-02-22 15:27:40 +0100 |
commit | 469efb904b59f137ac9e85e5ff23edd0c113de5c (patch) | |
tree | 71fab5f5715ec9f88984450cdabb592cd49dd46d /src/symmetry.h | |
parent | 38089071300b8e04ed42236dd08d9055094fb3b8 (diff) |
Move a load more stuff into libcrystfel
Diffstat (limited to 'src/symmetry.h')
-rw-r--r-- | src/symmetry.h | 63 |
1 files changed, 0 insertions, 63 deletions
diff --git a/src/symmetry.h b/src/symmetry.h deleted file mode 100644 index 071ebbde..00000000 --- a/src/symmetry.h +++ /dev/null @@ -1,63 +0,0 @@ -/* - * symmetry.h - * - * Symmetry - * - * (c) 2006-2010 Thomas White <taw@physics.org> - * - * Part of CrystFEL - crystallography with a FEL - * - */ - - -#ifndef SYMMETRY_H -#define SYMMETRY_H - -#ifdef HAVE_CONFIG_H -#include <config.h> -#endif - -/** - * SymOpList - * - * The SymOpList is an opaque data structure containing a list of point symmetry - * operations. It could represent an point group or a list of indexing - * ambiguities (twin laws), or similar. - **/ -typedef struct _symoplist SymOpList; - -/** - * SymOpMask - * - * The SymOpMask is an opaque data structure containing a list of flags - * associated with point symmetry operations in a specific %SymOpList. It is - * used to filter the operations in the %SymOpList to avoid duplicating - * equivalent reflections when the reflection is somehow special (e.g. 'hk0'). - **/ -typedef struct _symopmask SymOpMask; - -extern void free_symoplist(SymOpList *ops); -extern SymOpList *get_pointgroup(const char *sym); - -extern SymOpMask *new_symopmask(const SymOpList *list); -extern void free_symopmask(SymOpMask *m); - -extern void special_position(const SymOpList *ops, SymOpMask *m, - signed int h, signed int k, signed int l); -extern void get_asymm(const SymOpList *ops, - signed int h, signed int k, signed int l, - signed int *hp, signed int *kp, signed int *lp); -extern int num_equivs(const SymOpList *ops, const SymOpMask *m); -extern void get_equiv(const SymOpList *ops, const SymOpMask *m, int idx, - signed int h, signed int k, signed int l, - signed int *he, signed int *ke, signed int *le); - -extern SymOpList *get_ambiguities(const SymOpList *source, - const SymOpList *target); -extern int is_subgroup(const SymOpList *source, const SymOpList *target); - -extern int is_centrosymmetric(const SymOpList *s); -extern const char *symmetry_name(const SymOpList *ops); -extern void describe_symmetry(const SymOpList *s); - -#endif /* SYMMETRY_H */ |