source: tests/regression/Selection/Atoms/AtomById/testsuite-selection-unselect-atom-by-id.at@ adb51ab

#
#    MoleCuilder - creates and alters molecular systems
#    Copyright (C) 2008-2012 University of Bonn
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#
### 6. (un)select atom by id


AT_SETUP([Unselection - atom with specific id])
AT_KEYWORDS([unselection id atom unselect-atom-by-id])
# go through all possible ids (0-7) and remove others
i=0
while test $i -lt 8; do
  file=id${i}_present.xyz
  # normal
  AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomById/pre/test.xyz $file])
  AT_CHECK([chmod u+w $file], 0)
  AT_CHECK([../../molecuilder -i $file -v 3 --select-all-atoms --unselect-atom-by-id ${i} -r], [], [ignore], [ignore])
  AT_CHECK([diff -I '.*Created by molecuilder.*' $file ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomById/post/id${i}_present.xyz])
  ((i+=1))
done
AT_CLEANUP


AT_SETUP([Unselection - atom with specific id with Undo])
AT_KEYWORDS([unselection id atom unselect-atom-by-id undo])
# go through all possible ids (0-7) and remove others
i=0
while test $i -lt 8; do
  file=id${i}_present.xyz
  # undo
  AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomById/pre/test.xyz $file])
  AT_CHECK([chmod u+w $file], 0)
  AT_CHECK([../../molecuilder -i $file -v 3 --select-all-atoms --unselect-atom-by-id ${i} --undo -r], [], [ignore], [ignore])
  AT_CHECK([diff -I '.*Created by molecuilder.*' $file ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomById/post/empty.xyz])
  ((i+=1))
done
AT_CLEANUP


AT_SETUP([Unselection - atom with specific id with Redo])
AT_KEYWORDS([unselection id atom unselect-atom-by-id redo])
# go through all possible ids (0-7) and remove others
i=0
while test $i -lt 8; do
  file=id${i}_present.xyz
  # redo
  AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomById/pre/test.xyz $file])
  AT_CHECK([chmod u+w $file], 0)
  AT_CHECK([../../molecuilder -i $file -v 3 --select-all-atoms --unselect-atom-by-id ${i} --undo --redo -r], [], [ignore], [ignore])
  AT_CHECK([diff -I '.*Created by molecuilder.*' $file ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomById/post/id${i}_present.xyz])
  ((i+=1))
done
AT_CLEANUP