@@ -6,9 +6,17 @@ 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. It also supports graph operations -such as substructure search, atom mapping, and depth-first traversal through -a Java-centric approach. +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: README.txt 371841c9ab43405ec5076ff37430251e607f8ed9 Rich Apodaca rapodaca@metamolecular.com http://github.com/rapodaca/mx/commit/e540d54de2503402a062b6513a5a2e63dd556885 e540d54de2503402a062b6513a5a2e63dd556885 2008-12-03T07:52:03-08:00 2008-12-03T07:52:03-08:00 updated README ea4652c81c131856a8cff3262188a1d6bbb0005f Rich Apodaca rapodaca@metamolecular.com