diff options
| author | Thomas White <taw@physics.org> | 2021-07-14 16:55:44 +0200 |
|---|---|---|
| committer | Thomas White <taw@physics.org> | 2021-07-14 16:55:44 +0200 |
| commit | 64f8d83d0cee3d886cb170310fe748df33633358 (patch) | |
| tree | 33b25f8cb36e785bb42527c3cbab48a5484aa134 /src | |
| parent | f199cda9a320f2bd70989698ab5d2f85f921feb5 (diff) | |
GUI: Add PinkIndexer options to command line
Diffstat (limited to 'src')
| -rw-r--r-- | src/gui_index.c | 29 |
1 files changed, 29 insertions, 0 deletions
diff --git a/src/gui_index.c b/src/gui_index.c index f9ba7b6b..ad1206e0 100644 --- a/src/gui_index.c +++ b/src/gui_index.c @@ -913,6 +913,35 @@ static char **indexamajig_command_line(const char *geom_filename, if ( indexing_params->no_peak_check ) add_arg(args, n_args++, "--no-check-peaks"); if ( indexing_params->no_cell_check ) add_arg(args, n_args++, "--no-check-cell"); + /* PinkIndexer-specific */ + if ( pinkindexer_used(indexing_params->indexing_methods) ) { + add_arg_int(args, n_args++, + "pinkIndexer-considered-peaks-count", + indexing_params->pinkindexer_cpeaks); + if ( indexing_params->pinkindexer_use_max_res ) { + add_arg_float(args, n_args++, + "pinkIndexer-max-resolution-for-indexing", + indexing_params->pinkindexer_max_res); + } + add_arg_int(args, n_args++, + "pinkIndexer-angle-resolution", + indexing_params->pinkindexer_angle_density); + add_arg_int(args, n_args++, + "pinkIndexer-refinement-type", + indexing_params->pinkindexer_refinement_type); + add_arg_float(args, n_args++, + "pinkIndexer-tolerance", + indexing_params->pinkindexer_tolerance); + if ( indexing_params->pinkindexer_use_refl_radius ) { + add_arg_float(args, n_args++, + "pinkIndexer-reflection-radius", + indexing_params->pinkindexer_refl_radius); + } + add_arg_float(args, n_args++, + "pinkIndexer-max-refinement-disbalance", + indexing_params->pinkindexer_max_imbalance); + } + /* Integration */ add_arg(args, n_args++, "--integration"); add_arg(args, n_args++, indexing_params->integration_method); |