From: "Miguel" <[EMAIL PROTECTED]> >I would think about this problem as a substructure search based upon a >SMILES pattern as the input specification. That may not be the most >powerful way to represent network subnets, but it is certainly one of the >most practical for chemists.
I searched some documentation about SMILES patterns, didn't have much success. But I found documentation about SMARTS patterns, which seems more powerful than just SMILES : http://www.daylight.com/dayhtml/doc/theory/theory.smarts.html I will look more into this when I find some time (probably in a few weeks after my holidays). Nicolas ------------------------------------------------------- SF email is sponsored by - The IT Product Guide Read honest & candid reviews on hundreds of IT Products from real users. Discover which products truly live up to the hype. Start reading now. http://ads.osdn.com/?ad_id=6595&alloc_id=14396&op=click _______________________________________________ Jmol-users mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/jmol-users
