I'm new to the list. I am very much a user, rather than a developer. However, it was recommended to me that I post my question here to get the most current feedback.
I am interested learning about the best possibilities regarding generating reasonable 3D (mol) data from (for example ) SMILES. The announcement about FROG code prompted this interest. I belong to a community of chemists using LON-CAPA (loncapa.org) to create and reuse educational assessment resources. We currently use JMOL and JME and would like to incorporate into the loncapa distribution a way in which non-expert users could generate mol files to use with JMOL, perhaps even from student submissions of SMILES generated by JME, but initially for use by authors who need to quickly produce a 3D view of a molecule in their resource. Thanks for any suggestions/advice in advance. Ray -- http://www.sfu.ca/loncapaconference/ Raymond J. Batchelor Dept of Chemistry Simon Fraser University ------------------------------------------------------------------------- This SF.net email is sponsored by: Microsoft Defy all challenges. Microsoft(R) Visual Studio 2008. http://clk.atdmt.com/MRT/go/vse0120000070mrt/direct/01/ _______________________________________________ Blueobelisk-discuss mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/blueobelisk-discuss
