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vaidyanathanms / votca

Automatically exported from code.google.com/p/votca
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Check validity of box matrix #125

Open GoogleCodeExporter opened 9 years ago

GoogleCodeExporter commented 9 years ago 
All pbc algorithms have special conditions which are not checked currently. 
This should be done in setBox, make this function virutal which also allows to 
initialize other variables for the pbc algorithm which might be required in 
future.

Original issue reported on code.google.com by victor.r...@gmail.com on 30 Mar 2012 at 10:02