Nicolas,
When this shows up on the download site, let me know.
What I downloaded (prerelease 10.00.32)
seems to really be 10.00.11, and the other one there,
10.00.24, I can't read.
Bob
Nicolas Vervelle wrote:
Hi Bob,
Bob Hanson wrote:
Jmol users:
I'd like to bring the script documentation up to date.
My last entry at http://www.stolaf.edu/people/hansonr/jmol/docs
was 5/24/05. Please reply with any suggestions you have to
correct or update this site based on your interests.
I don't think the substructure() expression is currently documented
(recent addition).
It can be used to select atoms based on a SMILES pattern.
For example :
- select substructure("O") will select water
- select substructure("C=C") will select C2H4
Nicolas
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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
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