From: <bao...@us...> - 2006-07-12 10:37:58
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Revision: 237 Author: baoilleach Date: 2006-07-12 03:37:40 -0700 (Wed, 12 Jul 2006) ViewCVS: http://svn.sourceforge.net/cclib/?rev=237&view=rev Log Message: ----------- Bug fix: Mo4OSibdt2-opt.log has no atomcoords despite being a geo-opt. This was due to the fact that the parser was extracting "Input orientation" and not "Standard orientation". It's now changed to "Standard orientation" which works for all of the files in the repository. Added regression test. Added directory Gaussian03 to data/Gaussian and told SVN to ignore it. Edited the logfiledist so that it will include this folder when create the logfile distribution. Modified Paths: -------------- trunk/logfiledist trunk/src/cclib/parser/gaussianparser.py trunk/test/regression.py Property Changed: ---------------- trunk/data/Gaussian/ This was sent by the SourceForge.net collaborative development platform, the world's largest Open Source development site. |