source: tests/regression/Selection/Molecules/MoleculeByName/testsuite-selection-select-molecules-by-name.at@ 4a4f3d

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Last change on this file since 4a4f3d was e611dc, checked in by Frederik Heber <heber@…>, 14 years ago

FIX: AT_KEYWORDS requires _space_-separated list of keywords.
  • Property mode set to 100644
File size: 2.0 KB
Line 
1### 5. (un)select molecule by name
2
3AT_SETUP([Selection - Molecules by name])
4AT_KEYWORDS([selection molecule select-molecules-by-name])
5
6regressionpath="${abs_top_srcdir}/tests/regression/Selection/Molecules/MoleculeByName"
7srcfile=test.xyz
8testfile=test.xyz
9targetfile=water.xyz
10AT_CHECK([cp -n ${regressionpath}/pre/$srcfile $testfile], 0)
11AT_CHECK([../../molecuilder -i $testfile -I --select-molecule-by-id 0 --change-molname \"water\" --unselect-molecule-by-id 0 --select-molecules-by-name \"water\" -s $targetfile], 0, [stdout], [stderr])
12AT_CHECK([diff -I '.*Created by molecuilder.*' $targetfile ${regressionpath}/post/$targetfile], 0, [ignore], [ignore])
13
14AT_CLEANUP
15
16
17AT_SETUP([Selection - Molecules by name with Undo])
18AT_KEYWORDS([selection molecule select-molecules-by-name undo])
19
20regressionpath="${abs_top_srcdir}/tests/regression/Selection/Molecules/MoleculeByName"
21srcfile=test.xyz
22testfile=test.xyz
23targetfile=empty.xyz
24AT_CHECK([cp -n ${regressionpath}/pre/$srcfile $testfile], 0)
25AT_CHECK([../../molecuilder -i $testfile -I --select-molecule-by-id 0 --change-molname \"water\" --unselect-molecule-by-id 0 --select-molecules-by-name \"water\" --undo -s $targetfile], 0, [stdout], [stderr])
26AT_CHECK([diff -I '.*Created by molecuilder.*' $targetfile ${regressionpath}/post/$targetfile], 0, [ignore], [ignore])
27
28AT_CLEANUP
29
30
31AT_SETUP([Selection - Molecules by name with Redo])
32AT_KEYWORDS([selection molecule select-molecules-by-name redo])
33
34regressionpath="${abs_top_srcdir}/tests/regression/Selection/Molecules/MoleculeByName"
35srcfile=test.xyz
36testfile=test.xyz
37targetfile=water.xyz
38AT_CHECK([cp -n ${regressionpath}/pre/$srcfile $testfile], 0)
39AT_CHECK([../../molecuilder -i $testfile -I --select-molecule-by-id 0 --change-molname \"water\" --unselect-molecule-by-id 0 --select-molecules-by-name \"water\" --undo --redo -s $targetfile], 0, [stdout], [stderr])
40AT_CHECK([diff -I '.*Created by molecuilder.*' $targetfile ${regressionpath}/post/$targetfile], 0, [ignore], [ignore])
41
42AT_CLEANUP
43
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