diff options
Diffstat (limited to 'libcrystfel/src/predict-refine.c')
| -rw-r--r-- | libcrystfel/src/predict-refine.c | 8 |
1 files changed, 4 insertions, 4 deletions
diff --git a/libcrystfel/src/predict-refine.c b/libcrystfel/src/predict-refine.c index ba1bb3ae..32d0f77b 100644 --- a/libcrystfel/src/predict-refine.c +++ b/libcrystfel/src/predict-refine.c @@ -366,7 +366,7 @@ static int cmpd2(const void *av, const void *bv) a = (struct reflpeak *)av; b = (struct reflpeak *)bv; - if ( fabs(r_dev(a)) < fabs(r_dev(b)) ) return -1; + if ( fabs(get_exerr(a->refl)) < fabs(get_exerr(b->refl)) ) return -1; return 1; } @@ -383,10 +383,10 @@ static int check_outlier_transition(struct reflpeak *rps, int n, for ( i=1; i<n-1; i++ ) { int j; - double grad = fabs(r_dev(&rps[i])) / i; + double grad = fabs(get_exerr(rps[i].refl)) / i; for ( j=i+1; j<n; j++ ) { - if ( fabs(r_dev(&rps[j])) < 0.001e9+grad*j ) { + if ( fabs(get_exerr(rps[j].refl)) < 0.001e9+grad*j ) { break; } } @@ -576,7 +576,7 @@ int refine_radius(Crystal *cr, struct image *image) qsort(rps, n_acc, sizeof(struct reflpeak), cmpd2); n = (n_acc-1) - n_acc/50; if ( n < 2 ) n = 2; /* n_acc is always >= 2 */ - crystal_set_profile_radius(cr, fabs(r_dev(&rps[n]))); + crystal_set_profile_radius(cr, fabs(get_exerr(rps[n].refl))); reflist_free(reflist); free(rps); |