Thanks Bob. Looks good.
I tried about 10 comparisons on my HTML5 page, and they were all correct.
Otis
--
Otis Rothenberger
[email protected]
http://chemagic.com
On Jan 17, 2013, at 7:34 PM, Robert Hanson wrote:
> found it! OK, that was very helpful, Otis. We now have full SMILES matching
> support, I think.
>
> load $caffeine
> print compare({*},{*},"isomer")
>
> IDENTICAL
>
>
> I've added the package
>
> coresmiles.z.js
>
>
> see
>
> http://chemapps.stolaf.edu/jmol/jsmol.zip
>
> Also, I still had a debugging comment in both JSmol and Jmol in the
> autobonding method. So that's gone now, and I noticed some problems with
> Safari 5.1 loading after I went to double precision. I think that is fixed.
> Nick, please check that problem with the pop-up menu in Safari. I might have
> fixed that. (Or there is a bug in jQuery.)
>
> Time to release Jmol 13.1.12...
>
> Bob
>
>
>
>
>
> --
> Robert M. Hanson
> Larson-Anderson Professor of Chemistry
> Chair, Chemistry Department
> St. Olaf College
> Northfield, MN
> http://www.stolaf.edu/people/hansonr
>
>
> If nature does not answer first what we want,
> it is better to take what answer we get.
>
> -- Josiah Willard Gibbs, Lecture XXX, Monday, February 5, 1900
>
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