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Last change on this file since 1d5afa5 was 4e855e, checked in by Frederik Heber <heber@…>, 14 years ago

BondGraph::LoadBondLengthTable() now accepts istream instead of const char *.

This has been quite a lot of work because the matrix parsing is involved.
Hence, the fix is not really clean, this should get fixed as soon as we deal with the BondGraph implementation.
This fixes ticket #130.

Property mode set to 100644

File size: 2.1 KB

Rev	Line
[8c574b]	1	AT_BANNER([MoleCuilder - Graph routines test])
	2	# 1. DFS analysis
	3	AT_SETUP([Graph - DFS analysis])
	4	AT_KEYWORDS([graph])
	5	AT_CHECK([/bin/cp -f ${abs_top_srcdir}/${AUTOTEST_PATH}/Graph/1/pre/test.conf .], 0)
[e6f9c5]	6	AT_CHECK([../../molecuilder -i test.conf -v 3 -D 2.], 0, [stdout], [stderr])
[8c574b]	7	AT_CHECK([fgrep -c "No rings were detected in the molecular structure." stdout], 0, [1
	8	], [ignore])
	9	AT_CLEANUP
	10
[4e855e]	11	AT_SETUP([Graph - DFS analysis with bond length table])
	12	AT_KEYWORDS([graph])
	13	AT_CHECK([/bin/cp -f ${abs_top_srcdir}/${AUTOTEST_PATH}/Graph/1/pre/test2.conf .], 0)
	14	AT_DATA([table1.dat],[. H
	15	H 1.
	16	])
	17	AT_DATA([table2.dat],[. H
	18	H 1.5
	19	])
	20	AT_CHECK([../../molecuilder -i test2.conf -v 4 -g table1.dat -D 2.], 0, [stdout], [stderr])
	21	AT_CHECK([fgrep -c "Ion_Type1_1" stdout], 0, [2
	22	], [ignore])
	23	AT_CHECK([../../molecuilder -i test2.conf -v 4 -g table2.dat -D 3.], 0, [stdout], [stderr])
	24	AT_CHECK([fgrep -c "Ion_Type1_1" stdout], 0, [1
	25	], [ignore])
	26	AT_CHECK([fgrep -c "Ion_Type1_2" stdout], 0, [1
	27	], [ignore])
	28	AT_CLEANUP
	29
[8c574b]	30	AT_SETUP([Graph - subgraph dissection])
	31	AT_KEYWORDS([graph])
	32	AT_CHECK([/bin/cp -f ${abs_top_srcdir}/${AUTOTEST_PATH}/Graph/2/pre/test.conf .], 0)
[e6f9c5]	33	AT_CHECK([../../molecuilder -i test.conf -v 3 -I], 0, [stdout], [stderr])
[8c574b]	34	AT_CHECK([fgrep "I scanned 31 molecules." stdout], 0, [ignore], [ignore])
	35	AT_CLEANUP
	36
[faa1c9]	37	AT_SETUP([Graph - subgraph dissection with Undo/Redo])
	38	AT_KEYWORDS([graph])
	39	AT_CHECK([/bin/cp -f ${abs_top_srcdir}/${AUTOTEST_PATH}/Graph/2/pre/test.conf .], 0)
[e6f9c5]	40	AT_CHECK([../../molecuilder -i test.conf -v 3 -I], 0, [stdout], [stderr])
[faa1c9]	41	AT_CHECK([fgrep "I scanned 31 molecules." stdout], 0, [ignore], [ignore])
	42	AT_CHECK([/bin/cp -f ${abs_top_srcdir}/${AUTOTEST_PATH}/Graph/2/pre/test.conf .], 0)
[e6f9c5]	43	AT_CHECK([../../molecuilder -i test.conf -v 3 -I --undo], 0, [stdout], [stderr])
[faa1c9]	44	AT_CHECK([fgrep "I scanned 31 molecules." stdout], 0, [ignore], [ignore])
	45	AT_CHECK([/bin/cp -f ${abs_top_srcdir}/${AUTOTEST_PATH}/Graph/2/pre/test.conf .], 0)
[e6f9c5]	46	AT_CHECK([../../molecuilder -i test.conf -v 3 -I --undo --redo], 0, [stdout], [stderr])
[faa1c9]	47	AT_CHECK([grep -c "I scanned 31 molecules." stdout], 0, [2
	48	], [ignore])
	49	AT_CLEANUP
	50

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