From: SourceForge.net <no...@so...> - 2009-09-12 04:25:59
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Patches item #2855925, was opened at 2009-09-10 06:54 Message generated for change (Comment added) made by rajarshi You can respond by visiting: https://sourceforge.net/tracker/?func=detail&atid=320024&aid=2855925&group_id=20024 Please note that this message will contain a full copy of the comment thread, including the initial issue submission, for this request, not just the latest update. Category: None Group: Needs Review Status: Open Resolution: None Priority: 5 Private: No Submitted By: Egon Willighagen (egonw) Assigned to: Nobody/Anonymous (nobody) Summary: Patch to solve bug #2855850: setStereo(IBond.Stereo) Initial Comment: Aimed as CDK master, so 1 senior review required, all other welcome. The patch changes the CDK API for IBond.set/getStereo() to use IBond.Stereo (new) instead of int. Note that: * there are minor code interpretations in SmilesGenerator, ModelBuilder3D and BondTools * added two unit tests for MDL molfile reading to test the stereo type mapping ---------------------------------------------------------------------- >Comment By: Rajarshi Guha (rajarshi) Date: 2009-09-12 00:25 Message: Looks OK (though it'd be easier if the core changes were in a separate patch). ---------------------------------------------------------------------- You can respond by visiting: https://sourceforge.net/tracker/?func=detail&atid=320024&aid=2855925&group_id=20024 |