Re: [Open Babel] SDF conversion test results

2011-08-23 Thread Róbert Kiss
Great! Thanks Noel! Robert >-Original Message- >From: Noel O'Boyle [mailto:baoille...@gmail.com] >Sent: Tuesday, August 23, 2011 12:29 PM >To: Róbert Kiss >Cc: openbabel-discuss@lists.sourceforge.net; Chris Morley >Subject: Re: [Open Babel] SDF conversion test results > >I note that Chris

Re: [Open Babel] SDF conversion test results

2011-08-23 Thread Chris Morley
On 23/08/2011 11:29, Noel O'Boyle wrote: > I note that Chris has fixed some problems with metals, and we're down > to 146 failures. Some notes on this are below. (I was waiting to make sure the changes didn't cause mass test failure.) On 09/08/2011 13:39, Róbert Kiss wrote: > We recently did so

Re: [Open Babel] SDF conversion test results

2011-08-23 Thread Noel O'Boyle
I note that Chris has fixed some problems with metals, and we're down to 146 failures. Of these 57 have a particular substructure that appears to confuse OB. - Noel -- Get a FREE DOWNLOAD! and learn more about uberSVN ri