Hi Arne,
PyMOL can read various cube-type files. Find the common format between
Gaussian and PyMOL and use that one. After it's loaded into PyMOL you
can represent the data as isomesh, isocontour, slice, gradient, and
volume.
Cheers,
-- Jason
On Sun, Dec 18, 2011 at 3:38 PM, Arne Dieckmann wro
Dear all,
how would I render molecular orbitals in pymol? I thought about exporting a
cube-file from Gaussian containing a specific MO and importing this into pymol.
Is that possible? If not, how would I do this? Thanks a lot!
Cheers,
Arne
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