From: Karol L. <kar...@kn...> - 2007-02-17 13:05:56
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On Saturday 17 of February 2007 13:20, Noel O'Boyle wrote: > Almost ready to release...we just need to get a few tests to pass and > polish off some attributes. Here's what I've been doing/thinking as > well as some suggestions... > (1) I've uploaded MP files for GAMESS-UK. All that's left is Jaguar, > which I guess Adam will have to look into. Possibly, PC-GAMESS > too...I'll look into that. Thanks for the MP files for GAMESS-UK. Like I said, I'll take care of parsing mpenergies, but not before tommorow evening (some other urgent work). I already have most of it done. > (2) I've simplified testMP (no need to overload testsizeandshape and > testchange), and added the tests for GAMESS-UK (which currently fail). That was my quick hack to make the docstrings different for MP2/MP3/MP4/MP5. Cheers, Karol -- written by Karol Langner Sat Feb 17 14:00:46 CET 2007 |