MongoChem

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Revision as of 11:45, 8 March 2012 by Kyle.lutz (talk | contribs)
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ChemData is a Qt application that uses MongoDB to store its data, and VTK to visualize/explore data.

Get ChemData

The source code is available at Github.

Screenshots

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    Main ChemData Window

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    Scatter Plot Matrix Dialog displaying five different descriptors for the molecules in the database.

Developer Information

For a description of the data schema see: ChemData Schema.

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