Macs in Chemistry

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Molecular Query Language

 

This looks interesting Molecular Query Language (MolQL) a declarative language for describing selections/substructures of molecular data. The language provides a wide range of queries and can be used as a compilation target for various selection expressions such as the ones provided by PyMol, JMOL, or VMD.

There are a number of examples that you can explore in your web browser here.


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