diff options
Diffstat (limited to 'libcrystfel/src')
-rw-r--r-- | libcrystfel/src/crystal.c | 17 | ||||
-rw-r--r-- | libcrystfel/src/crystal.h | 2 |
2 files changed, 19 insertions, 0 deletions
diff --git a/libcrystfel/src/crystal.c b/libcrystfel/src/crystal.c index e1ad5dfe..91c3fd52 100644 --- a/libcrystfel/src/crystal.c +++ b/libcrystfel/src/crystal.c @@ -69,6 +69,9 @@ struct _crystal /* User flag, e.g. for "this is a bad crystal". */ int user_flag; + + /* Text notes, which go in the stream */ + char *notes; }; @@ -95,6 +98,7 @@ Crystal *crystal_new() cryst->resolution_limit = 0.0; cryst->n_saturated = 0; cryst->n_implausible = 0; + cryst->notes = NULL; return cryst; } @@ -207,6 +211,12 @@ double crystal_get_mosaicity(Crystal *cryst) } +const char *crystal_get_notes(Crystal *cryst) +{ + return cryst->notes; +} + + /********************************** Setters ***********************************/ @@ -274,3 +284,10 @@ void crystal_set_mosaicity(Crystal *cryst, double m) { cryst->m = m; } + + +void crystal_set_notes(Crystal *cryst, const char *notes) +{ + free(cryst->notes); /* free(NULL) is OK */ + cryst->notes = strdup(notes); +} diff --git a/libcrystfel/src/crystal.h b/libcrystfel/src/crystal.h index 6863f666..92f60fc3 100644 --- a/libcrystfel/src/crystal.h +++ b/libcrystfel/src/crystal.h @@ -65,6 +65,7 @@ extern double crystal_get_osf(Crystal *cryst); extern double crystal_get_Bfac(Crystal *cryst); extern struct image *crystal_get_image(Crystal *cryst); extern double crystal_get_mosaicity(Crystal *cryst); +extern const char *crystal_get_notes(Crystal *cryst); extern void crystal_set_cell(Crystal *cryst, UnitCell *cell); extern void crystal_set_profile_radius(Crystal *cryst, double r); @@ -79,6 +80,7 @@ extern void crystal_set_osf(Crystal *cryst, double osf); extern void crystal_set_Bfac(Crystal *cryst, double B); extern void crystal_set_image(Crystal *cryst, struct image *image); extern void crystal_set_mosaicity(Crystal *cryst, double m); +extern void crystal_set_notes(Crystal *cryst, const char *notes); #ifdef __cplusplus } |