### 6. (un)select atom by id AT_SETUP([Unselection - atom with specific id]) AT_KEYWORDS([unselection,id,atom]) # 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 ${abs_top_srcdir}/${AUTOTEST_PATH}/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 ${abs_top_srcdir}/${AUTOTEST_PATH}/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]) # 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 ${abs_top_srcdir}/${AUTOTEST_PATH}/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 ${abs_top_srcdir}/${AUTOTEST_PATH}/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]) # 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 ${abs_top_srcdir}/${AUTOTEST_PATH}/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 ${abs_top_srcdir}/${AUTOTEST_PATH}/Selection/Atoms/AtomById/post/id${i}_present.xyz]) ((i+=1)) done AT_CLEANUP