Phil,

Thanks for posting this. I just took a look and played with some of the features:

1) It has all the hooks to link it to Jmol - getSmiles() and getMolfile(). The are easy to access via JavaScript. 2) It has stereo SMILES. I don't know if they are unique, but that doesn't seem to matter any more. 3) The returned molfile have stereo information in the info part of the bond connection table (a new concept to me). Bob's post indicates that Jmol will read these.
4) It's about 400 k - but the stuff will be cached - half of this is images.

Upside: It's free for concommercial use.
Downside: It's not open source.

I'm going to connect it to our student model kit to see how it looks and works.

Otis


Otis Rothenberger
chemagic.com


On 6/30/2010 9:01 AM, Philip Bays wrote:
I just got notification this morning of a new release of JSDraw -- a structure drawing program that exports SMILES with a nice interface, written completed in JavaScript. I have not looked at it much yet, but it looks interesting. Anyone else have any experience with it?

http://www.chemene.com:8080/web/jsdraw.aspx

Phil

J. Philip Bays

Professor of Chemistry

Science Hall 172

Saint Mary's College

Notre Dame IN 46556

(574) 284-4663



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