### parsing xyz

AT_SETUP([Parser - loading xyz file with multiple time steps])
AT_KEYWORDS([parser load xyz timesteps])

file=testmulti.xyz
AT_CHECK([../../molecuilder -i $file -o xyz -l ${abs_top_srcdir}/tests/regression/Parser/Xyz/pre/testmulti.xyz], 0, [ignore], [ignore])
AT_CHECK([diff -I '.*Created by molecuilder.*' $file ${abs_top_srcdir}/tests/regression/Parser/Xyz/post/testmulti.xyz], 0, [ignore], [ignore])

AT_CLEANUP


AT_SETUP([Parser - loading xyz file with multiple time steps with Undo])
AT_KEYWORDS([parser load xyz timesteps undo])

file=testmulti.xyz
AT_CHECK([../../molecuilder -i $file -o xyz -l ${abs_top_srcdir}/tests/regression/Parser/Xyz/pre/testmulti.xyz --undo], 0, [ignore], [ignore])
AT_CHECK([diff -I '.*Created by molecuilder.*' $file ${abs_top_srcdir}/tests/regression/Parser/Xyz/post/empty.xyz], 0, [ignore], [ignore])

AT_CLEANUP


AT_SETUP([Parser - loading xyz file with multiple time steps with Redo])
AT_KEYWORDS([parser load xyz timesteps redo])

file=testmulti.xyz
AT_CHECK([../../molecuilder -i $file -o xyz -l ${abs_top_srcdir}/tests/regression/Parser/Xyz/pre/testmulti.xyz --undo --redo], 0, [ignore], [ignore])
AT_CHECK([diff -I '.*Created by molecuilder.*' $file ${abs_top_srcdir}/tests/regression/Parser/Xyz/post/testmulti.xyz], 0, [ignore], [ignore])

AT_CLEANUP