diff options
| author | Thomas White <taw@physics.org> | 2015-01-20 16:10:04 +0100 |
|---|---|---|
| committer | Thomas White <taw@physics.org> | 2015-01-20 16:10:04 +0100 |
| commit | 38f81ac432e313ed451eceb80c3f36ba6f1008e8 (patch) | |
| tree | d354c0adc18e53fc935310fe4681e80d949a3ff1 /src/check_hkl.c | |
| parent | 15931c364e2ee96bcd545b33ef5bc0db9e52341f (diff) | |
Add informational messages when symmetry doesn't match for monoclinic point groups
Diffstat (limited to 'src/check_hkl.c')
| -rw-r--r-- | src/check_hkl.c | 13 |
1 files changed, 11 insertions, 2 deletions
diff --git a/src/check_hkl.c b/src/check_hkl.c index 69ec34ef..0449c7a9 100644 --- a/src/check_hkl.c +++ b/src/check_hkl.c @@ -3,11 +3,11 @@ * * Characterise reflection lists * - * Copyright © 2012-2014 Deutsches Elektronen-Synchrotron DESY, + * Copyright © 2012-2015 Deutsches Elektronen-Synchrotron DESY, * a research centre of the Helmholtz Association. * * Authors: - * 2010-2014 Thomas White <taw@physics.org> + * 2010-2015 Thomas White <taw@physics.org> * * This file is part of CrystFEL. * @@ -840,6 +840,10 @@ int main(int argc, char *argv[]) return 1; } cell = load_cell_from_file(cellfile); + if ( cell == NULL ) { + ERROR("Failed to load cell.\n"); + return 1; + } free(cellfile); raw_list = read_reflections(file); @@ -855,6 +859,11 @@ int main(int argc, char *argv[]) if ( check_list_symmetry(raw_list, sym) ) { ERROR("The input reflection list does not appear to" " have symmetry %s\n", symmetry_name(sym)); + if ( cell_get_lattice_type(cell) == L_MONOCLINIC ) { + ERROR("You may need to specify the unique axis in your " + "point group. The default is unique axis c.\n"); + ERROR("See 'man crystfel' for more details.\n"); + } return 1; } |