mlund/faunus — pull request #55 by LukasSukenik (2014-09-02 17:00:28+00:00)
Title: MoleculeData and Map

Hi

I finnished the changes for propertyBase and so on...

Its merged with latest faunus and working.

I kept the *.topo naming since its still uses both moleculeMap and conmbinations for grandCanonical.