OK, looks like this is a GO. We might see some tweaking of the file format, but
here are two examples:
http://www.stolaf.edu/people/hansonr/jmol/test/proto/ch3cl.jvxl
http://www.stolaf.edu/people/hansonr/jmol/test/proto/ethene.jvxl
Each of these contains two surfaces. Display them at:
http://www.stolaf.edu/people/hansonr/jmol/test/proto/new.htm
Now, while we are on this subject, what's the deal with mapping of, say
electrostatic potential onto these surfaces? I think this is what people
really want to do.
Does that involve two separate cube files?
Does it involve computing some value at every point in a surface file?
Miguel, do you suppose the secret to solvent-accessible surfaces is to
express them in terms of isosurfaces?
Bob
--
--
Robert M. Hanson, [EMAIL PROTECTED], 507-646-3107
Professor of Chemistry, St. Olaf College
1520 St. Olaf Ave., Northfield, MN 55057
mailto:[EMAIL PROTECTED]
http://www.stolaf.edu/people/hansonr
"Imagination is more important than knowledge." - Albert Einstein
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