diff options
| author | Thomas White <taw@physics.org> | 2018-05-11 11:28:50 +0200 |
|---|---|---|
| committer | Thomas White <taw@physics.org> | 2018-05-11 11:28:50 +0200 |
| commit | 9180b2820c83550d4faedf84b93fba2c75c55891 (patch) | |
| tree | 90ac4d120b9e10b2a66969d0d9eb0a97f8bcf0b7 | |
| parent | 1f0987de8de5a1594623ab5d9fa24f1afe74dc93 (diff) | |
Much better way of stripping the audit information out of hkl files
| -rwxr-xr-x | scripts/create-mtz | 5 | ||||
| -rwxr-xr-x | tests/partialator_merge_check_1 | 5 | ||||
| -rwxr-xr-x | tests/partialator_merge_check_2 | 5 | ||||
| -rwxr-xr-x | tests/partialator_merge_check_3 | 5 |
4 files changed, 7 insertions, 13 deletions
diff --git a/scripts/create-mtz b/scripts/create-mtz index 62d94405..add9f093 100755 --- a/scripts/create-mtz +++ b/scripts/create-mtz @@ -22,10 +22,7 @@ if [ -e $OUTFILE ]; then fi fi -ex -c '/End of reflections/ -.,$d -w create-mtz.temp.hkl -q!' $1 +sed -n '/End\ of\ reflections/q;p' $1 > create-mtz.temp.hkl echo "Running 'f2mtz'..." f2mtz HKLIN create-mtz.temp.hkl HKLOUT $OUTFILE > out.html << EOF diff --git a/tests/partialator_merge_check_1 b/tests/partialator_merge_check_1 index d39c2009..3c9d1661 100755 --- a/tests/partialator_merge_check_1 +++ b/tests/partialator_merge_check_1 @@ -46,9 +46,8 @@ src/partialator -i partialator_merge_check_1.stream \ -o partialator_merge_check_1.hkl \ --model=unity --iterations=0 --no-scale --no-polarisation -ex -c '/End of reflections/ -.,$d -x' partialator_merge_check_1.hkl +sed -n '/End of reflections/q;p' partialator_merge_check_1.hkl > temp.hkl +mv temp.hkl partialator_merge_check_1.hkl diff partialator_merge_check_1.hkl partialator_merge_check_1_ans.hkl if [ $? -ne 0 ]; then exit 1 diff --git a/tests/partialator_merge_check_2 b/tests/partialator_merge_check_2 index 104f9fc4..9e7f51b3 100755 --- a/tests/partialator_merge_check_2 +++ b/tests/partialator_merge_check_2 @@ -51,9 +51,8 @@ src/partialator -i partialator_merge_check_2.stream \ --model=unity --iterations=1 --no-polarisation \ --no-free -ex -c '/End of reflections/ -.,$d -x' partialator_merge_check_2.hkl +sed -n '/End of reflections/q;p' partialator_merge_check_2.hkl > temp.hkl +mv temp.hkl partialator_merge_check_2.hkl diff partialator_merge_check_2.hkl partialator_merge_check_2_ans.hkl if [ $? -ne 0 ]; then exit 1 diff --git a/tests/partialator_merge_check_3 b/tests/partialator_merge_check_3 index 08f9f481..5370472d 100755 --- a/tests/partialator_merge_check_3 +++ b/tests/partialator_merge_check_3 @@ -53,9 +53,8 @@ src/partialator -i partialator_merge_check_3.stream \ --model=unity --iterations=1 -y 4 --no-polarisation \ --no-free -ex -c '/End of reflections/ -.,$d -x' partialator_merge_check_3.hkl +sed -n '/End\ of\ reflections/q;p' partialator_merge_check_3.hkl > temp.hkl +mv temp.hkl partialator_merge_check_3.hkl diff partialator_merge_check_3.hkl partialator_merge_check_3_ans.hkl if [ $? -ne 0 ]; then exit 1 |