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Cheminformatics for GWT
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MX - Cheminformatics for Java Public Repository: http://github.com/rapodaca/mx Mailing List: http://groups.google.com/group/mx-java Download: http://code.google.com/p/mx-java Blog: http://depth-first.com MX is a suite of lightweight, general purpose tools for cheminformatics. It currently supports: - molfile input and output - a subset of SMILES input - substructure search and atom mapping - depth-first traversal These features are implemented with an emphasis on readability and flexibility. MX has been successfully used in both the Ruby and Python scripting environments through JRuby and Jython. System requirements: - Ant - JDK 1.5 or higher
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