From: SourceForge.net <no...@so...> - 2004-01-27 10:27:50
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Bugs item #884993, was opened at 2004-01-26 20:51 Message generated for change (Comment added) made by steinbeck You can respond by visiting: https://sourceforge.net/tracker/?func=detail&atid=120024&aid=884993&group_id=20024 Category: org.openscience.cdk.layout Group: None >Status: Closed >Resolution: Fixed Priority: 5 Submitted By: Anatoli Krassavine (akrassavine) Assigned to: Christoph Steinbeck (steinbeck) Summary: Infinite loop on disconnected structures with rings Initial Comment: Further to my previous bug report. disconnected structures with rings in both fragments cause infinite loop in layout algorithm. For example: [N+](=O)([O-])C1=C(O)C(=CC(=C1)[N+](=O)[O-]) [N+](=O)[O-].C23N(CCCC2)CCCC3 Either frgament layouts and depicts correctly. Together they cause the CDK to go into infinite loop ---------------------------------------------------------------------- >Comment By: Christoph Steinbeck (steinbeck) Date: 2004-01-27 11:27 Message: Logged In: YES user_id=54358 The method now checks for disconnectedness and throws a CDKException if there are more than one structures in the molecule. ---------------------------------------------------------------------- You can respond by visiting: https://sourceforge.net/tracker/?func=detail&atid=120024&aid=884993&group_id=20024 |