#
#    MoleCuilder - creates and alters molecular systems
#    Copyright (C) 2021 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/>.
#
### print selected atoms as graph6

AT_SETUP([Graph - print selected atoms as graph6 string])
AT_KEYWORDS([graph print-selected-atoms-as-graphstring graph6])

file=test.data
AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Graph/PrintSelectedAtomsAsGraphString/pre/$file $file], 0)
AT_CHECK([chmod u+w $file], 0)
AT_CHECK([../../molecuilder \
        -i $file \
        --select-atom-by-element C \
	--print-selected-atoms-as-graphstring], 0, [stdout], [stderr])
AT_CHECK([fgrep "Bo" stdout], 0, [ignore], [ignore])

AT_CLEANUP