csg_inverse: clean up + test espresso interface

Pallavi-Banerjee21 / votca

Automatically exported from code.google.com/p/votca

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Closed GoogleCodeExporter closed 9 years ago

GoogleCodeExporter commented 9 years ago

-espresso interface hasn't been tested for a long time

Original issue reported on code.google.com by christop...@gmail.com on 15 Apr 2011 at 3:20

GoogleCodeExporter commented 9 years ago

-trajectory and topology also need some clean-up -> libblockfile from espresso 
3.0 could be used.

Original comment by christop...@gmail.com on 28 Apr 2011 at 12:52

GoogleCodeExporter commented 9 years ago

espresso is not uses a lot outside of cmu, we will just add a warning.

Original comment by christop...@gmail.com on 16 Jun 2011 at 1:41