Can Your Cheminformatics Tool Do This? 2

Posted by Rich Apodaca Wed, 13 Jun 2007 12:36:00 GMT

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  1. Christoph Steinbeck Wed, 13 Jun 2007 16:48:22 GMT

    In what sense? Represent the chemical information in the drawing? Draw this? Predict the outcome of the reaction, given the educts and conditions? :-) Cheers, Chris

  2. Richard Apodaca Wed, 13 Jun 2007 16:55:00 GMT

    Chris -all are, of course, important. But my main interest was in accurately representing the axial chirality of the allene.