source: tests/regression/Parser/Pdb/post/CONECTs_emptyspace.pdb@ adb51ab

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Last change on this file since adb51ab was 473237, checked in by Frederik Heber <heber@…>, 14 years ago

FIX: PdbParser - CONECTs with full 80 chars were not parsed correctly.

  • this fixes ticket #147.
  • also, we now write full length CONECTs.
  • added regression test to check on this behavior.
  • TESTFIX: Parser/Pdb/with-conects now diffs with '-w' to ignore white spaces errors. CONECT lines need not have full length.
  • TESTFIX: Molecules/BondFile/Fragmentation now diffs with '-w' as well.
  • Property mode set to 100644
File size: 399 bytes
Line 
1REMARK created by molecuilder on Sat Apr 30 15:23:23 2011, time step 0
2ATOM 1 OE2 0GLU A1 43.510 13.802 28.945 1.00 15.92 O 0
3HETATM 2 MN 0MN A1 45.531 14.928 28.983 1.00 18.19 MN 0
4CONECT 1 2
5CONECT 2 1
6END
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