source: tests/GuiChecks/Parser/Xyz/testsuite-parser-xyz-load-various.at@ eaf08f

#
#    MoleCuilder - creates and alters molecular systems
#    Copyright (C) 2008-2012 University of Bonn
#
#    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/>.
#
### parsing xyz

AT_SETUP([Parser - loading xyz file with empty comment])
AT_KEYWORDS([parser load xyz])

file=test.xyz
AT_DATA([test-emptycomment.xyz], [1

Ar 0. 0. 0.
])
AT_CHECK([../../molecuilder --dry-run -i $file -o xyz -l test-emptycomment.xyz --no-dry-run --store-session session-parser-xyz-load-various.py --session-type python], 0, [ignore], [ignore])
AT_CHECK([grep -v "Command.*DryRun" session-parser-xyz-load-various.py >session-parser-xyz-load-various_new.py], 0, [ignore], [ignore])
AT_CHECK([../../molecuilderguitest session-parser-xyz-load-various_new.py], 0, [ignore], [ignore])

AT_CLEANUP