[ghemical-devel] molecular surface
Geoff Hutchison
hutchisn@chem.northwestern.edu
Tue, 24 Jun 2003 17:29:15 -0500
On Monday, June 9, 2003, at 01:34 AM, Tommi Hassinen wrote:
> Yep, the surface/plane classes are at plane.cpp and surface.cpp. These
> classes do not have any "hard-coded" functions that they call to
> calculate
> the values.
I've always wondered if we could hack that a bit to store information
in the file format. That way you could display surfaces/cube data
around the molecule and use Ghemical for a viewer for other program
data. (Displaying MOs from other programs would be great too, but
that's a different subject.)
-Geoff