source: tests/regression/Parser/Pdb/testsuite-parser-pdb.at@ 7159ed

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Last change on this file since 7159ed was 7a1dd0, checked in by Frederik Heber <heber@…>, 15 years ago

Added regression tests on parsing present but empty files.

  • every Parser now first loads an empty file (no newlinw, 0 bytes) as initial regression test.
  • this closes ticket #131.
  • Property mode set to 100644
File size: 2.0 KB
Line 
1### parsing pdb
2
3AT_SETUP([Parser - loading empty pdb file])
4AT_KEYWORDS([parser,pdb,emptyfile])
5AT_CHECK([echo "" >test.pdb], 0, [ignore], [ignore])
6AT_CHECK([../../molecuilder -i test.pdb -o pdb], 0, [ignore], [ignore])
7AT_CLEANUP
8
9AT_SETUP([Parser - loading pdb file])
10AT_KEYWORDS([parser,pdb])
11AT_CHECK([../../molecuilder -i test.pdb -o pdb -l ${abs_top_srcdir}/${AUTOTEST_PATH}/Parser/Pdb/pre/test.pdb], 0, [ignore], [ignore])
12AT_CHECK([file=test.pdb; diff -I '.*created by molecuilder.*' $file ${abs_top_srcdir}/${AUTOTEST_PATH}/Parser/Pdb/post/$file], 0, [ignore], [ignore])
13AT_CLEANUP
14
15AT_SETUP([Parser - loading pdb file with CONECTs])
16AT_KEYWORDS([parser,pdb])
17AT_CHECK([../../molecuilder -i test_conect.pdb -o pdb -l ${abs_top_srcdir}/${AUTOTEST_PATH}/Parser/Pdb/pre/test_conect.pdb], 0, [ignore], [ignore])
18AT_CHECK([file=test_conect.pdb; diff -I '.*created by molecuilder.*' $file ${abs_top_srcdir}/${AUTOTEST_PATH}/Parser/Pdb/post/$file], 0, [ignore], [ignore])
19AT_CLEANUP
20
21AT_SETUP([Parser - loading pdb file with multiple time steps])
22AT_KEYWORDS([parser,pdb])
23AT_CHECK([../../molecuilder -v 4 -i testmulti.pdb -o pdb -l ${abs_top_srcdir}/${AUTOTEST_PATH}/Parser/Pdb/pre/testmulti.pdb], 0, [ignore], [ignore])
24AT_CHECK([file=testmulti.pdb; diff -I '.*created by molecuilder.*' $file ${abs_top_srcdir}/${AUTOTEST_PATH}/Parser/Pdb/post/$file], 0, [ignore], [ignore])
25AT_CHECK([../../molecuilder -v 4 -i testmulti2.pdb -o pdb -l ${abs_top_srcdir}/${AUTOTEST_PATH}/Parser/Pdb/pre/testmulti2.pdb], 0, [ignore], [ignore])
26AT_CHECK([file=testmulti2.pdb; diff -I '.*created by molecuilder.*' $file ${abs_top_srcdir}/${AUTOTEST_PATH}/Parser/Pdb/post/$file], 0, [ignore], [ignore])
27AT_CLEANUP
28
29AT_SETUP([Parser - saving pdb file])
30AT_KEYWORDS([parser,pdb])
31AT_CHECK([../../molecuilder -i test.pdb -o pdb -l ${abs_top_srcdir}/${AUTOTEST_PATH}/Parser/Pdb/pre/test.pdb --output store.pdb], 0, [ignore], [ignore])
32AT_CHECK([diff -I '.*created by molecuilder.*' store.pdb ${abs_top_srcdir}/${AUTOTEST_PATH}/Parser/Pdb/post/test.pdb], 0, [ignore], [ignore])
33AT_CLEANUP
34
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