From: <la...@us...> - 2007-08-04 22:46:18
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Revision: 708 http://cclib.svn.sourceforge.net/cclib/?rev=708&view=rev Author: langner Date: 2007-08-04 15:33:45 -0700 (Sat, 04 Aug 2007) Log Message: ----------- Added another condition so that ccopen recognizes Molpro log files. Made better Molpro GeoOpt test. Added code to Molpro parser for scftargets and scfvalues. Modified Paths: -------------- trunk/data/Molpro/basicMolpro2006/dvb_gopt.com trunk/data/Molpro/basicMolpro2006/dvb_gopt.log trunk/data/Molpro/basicMolpro2006/dvb_gopt.out trunk/src/cclib/parser/molproparser.py trunk/src/cclib/parser/utils.py trunk/test/testdata This was sent by the SourceForge.net collaborative development platform, the world's largest Open Source development site. |