cclib is an open source library, written in Python, for parsing and interpreting the results of computational chemistry packages. It currently parses output files from ADF, GAMESS, GAMESS-UK, Gaussian, Jaguar and PC GAMESS.


http://cclib.sourceforge.net/wiki





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2009-02-23

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Registered:

2006-03-01

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50% of 2 users recommend this project
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    posted by anonymous 62 days ago
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