### center atoms and adjusting boundary

AT_SETUP([Domain - set domain to minimum size])
AT_KEYWORDS([domain,center-edge])

file=test.conf
AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Domain/CenterOnEdge/pre/test.conf $file], 0)
AT_CHECK([chmod u+w $file], 0)
AT_CHECK([../../molecuilder -i $file  -O], 0, [stdout], [stderr])
AT_CHECK([fgrep "Box domain is now" stdout], 0, [ignore], [ignore])
AT_CHECK([diff $file ${abs_top_srcdir}/tests/regression/Domain/CenterOnEdge/post/test.conf], 0, [stdout], [stderr])

AT_CLEANUP


AT_SETUP([Domain - set domain to minimum size with Undo])
AT_XFAIL_IF([/bin/true])
AT_KEYWORDS([domain,center-edge,undo])

file=test.conf
AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Domain/CenterOnEdge/pre/test.conf $file], 0)
AT_CHECK([chmod u+w $file], 0)
AT_CHECK([../../molecuilder -i $file  -O --undo], 0, [stdout], [stderr])
AT_CHECK([fgrep "Box domain is now" stdout], 0, [ignore], [ignore])
AT_CHECK([diff $file ${abs_top_srcdir}/tests/regression/Domain/CenterOnEdge/post/test.conf], 0, [stdout], [stderr])

AT_CLEANUP


AT_SETUP([Domain - set domain to minimum size with Redo])
AT_XFAIL_IF([/bin/true])
AT_KEYWORDS([domain,center-edge,redo])

file=test.conf
AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Domain/CenterOnEdge/pre/test.conf $file], 0)
AT_CHECK([chmod u+w $file], 0)
AT_CHECK([../../molecuilder -i $file  -O --undo --redo], 0, [stdout], [stderr])
AT_CHECK([fgrep "Box domain is now" stdout], 0, [ignore], [ignore])
AT_CHECK([diff $file ${abs_top_srcdir}/tests/regression/Domain/CenterOnEdge/post/test.conf], 0, [stdout], [stderr])

AT_CLEANUP