#
#    MoleCuilder - creates and alters molecular systems
#    Copyright (C) 2014 Frederik Heber
#
#    This program is free software: you can redistribute it and/or modify
#    it under the terms of the GNU General Public License as published by
#    the Free Software Foundation, either version 3 of the License, or
#    (at your option) any later version.
#
#    This program is distributed in the hope that it will be useful,
#    but WITHOUT ANY WARRANTY; without even the implied warranty of
#    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
#    GNU General Public License for more details.
#
#    You should have received a copy of the GNU General Public License
#    along with this program.  If not, see <http://www.gnu.org/licenses/>.
#
### Translation-Periodic

AT_SETUP([Molecules - Translation with periodic boundaries])
AT_KEYWORDS([molecules translate-molecules])

file=test.conf
AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Molecules/Translation-Periodic/pre/test.conf $file], 0)
AT_CHECK([chmod u+w $file], 0)
AT_CHECK([../../molecuilder --dry-run -i $file  --select-molecule-by-id 0 --translate-molecules --position "-8., -8., -8." --periodic 1 --no-dry-run --store-session session-molecules-translation-periodic.py --session-type python], 0, [stdout], [stderr])
AT_CHECK([grep -v "Command.*DryRun" session-molecules-translation-periodic.py >session-molecules-translation-periodic_new.py], 0, [ignore], [ignore])
AT_CHECK([../../molecuilderguitest session-molecules-translation-periodic_new.py], 0, [stdout], [stderr])
AT_CHECK([diff $file ${abs_top_srcdir}/tests/regression/Molecules/Translation-Periodic/post/test.conf], 0, [ignore], [ignore])

AT_CLEANUP


AT_SETUP([Molecules - Translation with periodic boundaries with Undo])
AT_KEYWORDS([molecules translate-molecules undo])

file=test.conf
AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Molecules/Translation-Periodic/pre/test.conf $file], 0)
AT_CHECK([chmod u+w $file], 0)
AT_CHECK([../../molecuilder --dry-run -i $file  --select-molecule-by-id 0 --translate-molecules --position "-8., -8., -8." --periodic 1 --undo --no-dry-run --store-session session-molecules-translation-periodic.py --session-type python], 0, [stdout], [stderr])
AT_CHECK([grep -v "Command.*DryRun" session-molecules-translation-periodic.py >session-molecules-translation-periodic_new.py], 0, [ignore], [ignore])
AT_CHECK([../../molecuilderguitest session-molecules-translation-periodic_new.py], 0, [stdout], [stderr])
AT_CHECK([diff $file ${abs_top_srcdir}/tests/regression/Molecules/Translation-Periodic/post/test-undo.conf], 0, [ignore], [ignore])

AT_CLEANUP


AT_SETUP([Molecules - Translation with periodic boundaries with Redo])
AT_KEYWORDS([molecules translate-molecules redo])

file=test.conf
AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Molecules/Translation-Periodic/pre/test.conf $file], 0)
AT_CHECK([chmod u+w $file], 0)
AT_CHECK([../../molecuilder --dry-run -i $file  --select-molecule-by-id 0 --translate-molecules --position "-8., -8., -8." --periodic 1 --undo --redo --no-dry-run --store-session session-molecules-translation-periodic.py --session-type python], 0, [stdout], [stderr])
AT_CHECK([grep -v "Command.*DryRun" session-molecules-translation-periodic.py >session-molecules-translation-periodic_new.py], 0, [ignore], [ignore])
AT_CHECK([../../molecuilderguitest session-molecules-translation-periodic_new.py], 0, [stdout], [stderr])
AT_CHECK([diff $file ${abs_top_srcdir}/tests/regression/Molecules/Translation-Periodic/post/test.conf], 0, [ignore], [ignore])

AT_CLEANUP