diff options
Diffstat (limited to 'libcrystfel')
| -rw-r--r-- | libcrystfel/src/taketwo.c | 22 |
1 files changed, 11 insertions, 11 deletions
diff --git a/libcrystfel/src/taketwo.c b/libcrystfel/src/taketwo.c index 4655868c..129cdb4b 100644 --- a/libcrystfel/src/taketwo.c +++ b/libcrystfel/src/taketwo.c @@ -390,10 +390,10 @@ static gsl_matrix *generate_rot_mat(struct rvec obs1, struct rvec obs2, rotateSpotDiffMatrix, secondTwizzleMatrix, 0.0, fullMat); gsl_matrix_transpose(fullMat); - free(cell2v); - free(cell2vr); - free(secondTwizzleMatrix); - free(rotateSpotDiffMatrix); + gsl_vector_free(cell2v); + gsl_vector_free(cell2vr); + gsl_matrix_free(secondTwizzleMatrix); + gsl_matrix_free(rotateSpotDiffMatrix); return fullMat; } @@ -628,7 +628,7 @@ static signed int find_next_index(gsl_matrix *rot, struct SpotVec *obs_vecs, int all_ok = 1; for ( k=0; k<member_num; k++ ) { - gsl_matrix *test_rot = gsl_matrix_calloc(3, 3); + gsl_matrix *test_rot; struct rvec member_match; int idx_k = obs_members[k]; @@ -646,7 +646,7 @@ static signed int find_next_index(gsl_matrix *rot, struct SpotVec *obs_vecs, double trace = 0; int ok = rot_mats_are_similar(rot, test_rot, &trace); - free(test_rot); + gsl_matrix_free(test_rot); if (!ok) { all_ok = 0; @@ -760,7 +760,7 @@ static int start_seed(struct SpotVec *obs_vecs, int obs_vec_count, int i, int j, int i_match, int j_match, gsl_matrix **rotation, int *max_members) { - gsl_matrix *rot_mat = gsl_matrix_calloc(3, 3); + gsl_matrix *rot_mat; rot_mat = generate_rot_mat(obs_vecs[i].obsvec, obs_vecs[j].obsvec, @@ -1085,13 +1085,14 @@ static UnitCell *run_taketwo(UnitCell *cell, struct rvec *rlps, int rlp_count) success = match_obs_to_cell_vecs(cell_vecs, cell_vec_count, obs_vecs, obs_vec_count); - if ( !success ) return NULL; - cleanup_taketwo_cell_vecs(cell_vecs); + if ( !success ) return NULL; + int threshold_reached = find_seed(obs_vecs, obs_vec_count, &solution); if ( solution == NULL ) { + cleanup_taketwo_obs_vecs(obs_vecs, obs_vec_count); return NULL; } @@ -1128,9 +1129,8 @@ int taketwo_index(struct image *image, IndexingPrivate *ipriv) rlps[n_rlps++].w = 0.0; cell = run_taketwo(tp->cell, rlps, n_rlps); - if ( cell == NULL ) return 0; - free(rlps); + if ( cell == NULL ) return 0; cr = crystal_new(); if ( cr == NULL ) { |