[OpenBabel-Devel] [ openbabel-Bugs-3107218 ] OBBuilder terminates while building 3d

2010-11-11 Thread SourceForge.net
Bugs item #3107218, was opened at 2010-11-11 11:49 Message generated for change (Tracker Item Submitted) made by martinguetlein You can respond by visiting: https://sourceforge.net/tracker/?func=detailatid=428740aid=3107218group_id=40728 Please note that this message will contain a full copy of

[OpenBabel-Devel] Fwd: [Open Babel] Python test cases (Moving to OpenBabel-dev)

2010-11-11 Thread Noel O'Boyle
-- Forwarded message -- From: Andrew Dalke da...@dalkescientific.com Date: 11 November 2010 11:28 Subject: [Open Babel] Python test cases To: openbabel list openbabel-disc...@lists.sourceforge.net On 09/11/2010 13:53, Andrew Dalke wrote: I am also willing to write tests which

[OpenBabel-Devel] [ openbabel-Bugs-3107510 ] Calling OBSmarts.GetUMapList affects GetMapList

2010-11-11 Thread SourceForge.net
Bugs item #3107510, was opened at 2010-11-11 21:06 Message generated for change (Tracker Item Submitted) made by baoilleach You can respond by visiting: https://sourceforge.net/tracker/?func=detailatid=428740aid=3107510group_id=40728 Please note that this message will contain a full copy of the

[OpenBabel-Devel] [ openbabel-Bugs-3107516 ] Doc bug for OBBond.GetNbrAtom

2010-11-11 Thread SourceForge.net
Bugs item #3107516, was opened at 2010-11-11 21:09 Message generated for change (Tracker Item Submitted) made by baoilleach You can respond by visiting: https://sourceforge.net/tracker/?func=detailatid=428740aid=3107516group_id=40728 Please note that this message will contain a full copy of the

[OpenBabel-Devel] [ openbabel-Bugs-3107517 ] myAtom.IsConnected(myAtom) unexpected behaviour

2010-11-11 Thread SourceForge.net
Bugs item #3107517, was opened at 2010-11-11 21:10 Message generated for change (Tracker Item Submitted) made by baoilleach You can respond by visiting: https://sourceforge.net/tracker/?func=detailatid=428740aid=3107517group_id=40728 Please note that this message will contain a full copy of the

[OpenBabel-Devel] [ openbabel-Bugs-3107518 ] Debug output in OBAtom.HtoMethyl() should be removed?

2010-11-11 Thread SourceForge.net
Bugs item #3107518, was opened at 2010-11-11 21:11 Message generated for change (Tracker Item Submitted) made by baoilleach You can respond by visiting: https://sourceforge.net/tracker/?func=detailatid=428740aid=3107518group_id=40728 Please note that this message will contain a full copy of the

Re: [OpenBabel-Devel] [Open Babel] Python test cases (Moving to OpenBabel-dev)

2010-11-11 Thread Andrew Dalke
On Nov 11, 2010, at 9:58 PM, Noel O'Boyle replied to Andrew Dalke: Since I'm not (directly) calling WriteMolecule and since my test cases don't support the --gen2D or --gen3d flags, this warning isn't that helpful in a library function. This is by design (added recently). Up until recently,