diff options
| author | Thomas White <taw@bitwiz.org.uk> | 2011-02-06 21:20:01 +0100 |
|---|---|---|
| committer | Thomas White <taw@physics.org> | 2012-02-22 15:27:13 +0100 |
| commit | 1a206036c00ca86270fe59bfc475dd059bf38969 (patch) | |
| tree | 5c63c3cd610a0d936940a5278ed6ad4f6088032f /src/reflist.h | |
| parent | 155ca0064e5605a345d141202d6cbf7dce9a220b (diff) | |
Start work on binary tree
Diffstat (limited to 'src/reflist.h')
| -rw-r--r-- | src/reflist.h | 69 |
1 files changed, 69 insertions, 0 deletions
diff --git a/src/reflist.h b/src/reflist.h new file mode 100644 index 00000000..0ba09a3b --- /dev/null +++ b/src/reflist.h @@ -0,0 +1,69 @@ +/* + * reflist.h + * + * Fast reflection/peak list + * + * (c) 2011 Thomas White <taw@physics.org> + * + * Part of CrystFEL - crystallography with a FEL + * + */ + +#ifndef REFLIST_H +#define REFLIST_H + +#ifdef HAVE_CONFIG_H +#include <config.h> +#endif + + +typedef struct _reflist RefList; +typedef struct _reflection Reflection; + +#define INDICES signed int h, signed int k, signed int l + +/* Creation/deletion */ +extern RefList *reflist_new(void); +extern void reflist_free(RefList *list); + +/* Search */ +extern Reflection *find_refl(RefList *list, INDICES); + +/* Get */ +extern double get_excitation_error(Reflection *refl); +extern void get_detector_pos(Reflection *refl, double *x, double *y); +extern void get_indices(Reflection *refl, + signed int *h, signed int *k, signed int *l); +extern double get_partiality(Reflection *refl); +extern double get_intensity(Reflection *refl); +extern void get_partial(Reflection *refl, double *r1, double *r2, double *p, + int *clamp_low, int *clamp_high); +extern int get_scalable(Reflection *refl); + +/* Set */ +extern void set_detector_pos(Reflection *refl, double exerr, + double x, double y); +extern void set_partial(Reflection *refl, double r1, double r2, double p, + double clamp_low, double clamp_high); +extern void set_indices(Reflection *refl, + signed int h, signed int k, signed int l); +extern void set_int(Reflection *refl, double intensity); +extern void set_scalable(Reflection *refl, int scalable); + +/* Insertion */ +extern Reflection *add_refl(RefList *list, INDICES); +extern Reflection *add_refl_with_det_pos(RefList *list, INDICES, double exerr, + double x, double y); + + +/* Deletion */ +extern void delete_refl(Reflection *refl); + +/* Iteration */ +extern Reflection *first_refl(RefList *list); +extern Reflection *next_refl(Reflection *refl); + +/* Voodoo */ +extern void optimise_reflist(RefList *list); + +#endif /* REFLIST_H */ |