now documented. Question:
I'm seeing Red-white-blue, not a rainbow. Is that because I had to use the same .cube file
for both isosurface and map? But that doesn't exactly make sense to me....
Bob
Miguel wrote:
Jmol prerelease 10.00.42 is now available from
http://www.jmol.org/files
This release features support for coloring .cub file isosurfaces based
upon color
Example:
load "ch3cl-density.cub"; # read in the molecule - old functionality
isosurface mySurface 0.0004 "ch3cl-density.cub"; # old functionality
isosurface mySurface color "ch3cl-esp.cub"; # new functionality
color isosurface translucent;
OR, put it all on one line:
isosurface mySurface 0.0004 "ch3cl-density.cub" color "ch3cl-esp.cub";
OR, specify your own absolute range for color data values:
isosurface color absolute -0.1 0.5 "ch3cl-esp.cub";
Note that the subcommand names 'color' and 'absolute' are subject to change.
Thanks to Richard Spinney of Ohio State University (USA) for help on this.
It looks pretty cool ... Enjoy!
Miguel
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Professor of Chemistry, St. Olaf College
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mailto:[EMAIL PROTECTED]
http://www.stolaf.edu/people/hansonr
"Imagination is more important than knowledge." - Albert Einstein
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