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tests/regression/testsuite-filling.at
r9907e7 r8d4aa1 10 10 H 0.758602 0. -0.504284 11 11 ]]) 12 AT_CHECK([../../molecuilder test.conf -e ${abs_top_srcdir}/src/ -v 3 -F water.xyz --MaxDistance -1 --distances 3.1 3.1 3.1 --lengths 2.1 0. 0.--DoRotate 0], 0, [stdout], [stderr])12 AT_CHECK([../../molecuilder -i test.conf -e ${abs_top_srcdir}/src/ -v 3 -F water.xyz --MaxDistance -1 --distances "3.1, 3.1, 3.1" --lengths "2.1, 0., 0." --DoRotate 0], 0, [stdout], [stderr]) 13 13 AT_CHECK([file=test.conf; diff $file ${abs_top_srcdir}/${AUTOTEST_PATH}/Filling/1/post/$file], 0, [ignore], [ignore]) 14 14 AT_CLEANUP … … 18 18 AT_KEYWORDS([filling]) 19 19 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/${AUTOTEST_PATH}/Filling/2/pre/test.conf .], 0) 20 AT_CHECK([../../molecuilder test.conf -e ${abs_top_srcdir}/src/ -v 3-u 1.3], 0, [stdout], [stderr])20 AT_CHECK([../../molecuilder -i test.conf -e ${abs_top_srcdir}/src/ -v 3 --select-molecule-by-id 0 -u 1.3], 0, [stdout], [stderr]) 21 21 #AT_CHECK([file=test.conf; diff $file ${abs_top_srcdir}/${AUTOTEST_PATH}/Filling/2/post/$file], 0, [ignore], [ignore]) 22 22 AT_CLEANUP
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