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RInChI

RInChI Extended Toolkit

The aim of the RInChI project, in the same vein as InChI, is to create a unique data string to describe a reaction. Reaction InChIs, or RInChIs, are such data strings. They use the InChI software and from an rxn input file a RInChI can be created. The tools for doing this are below, and some helpful information is given in the help pages.

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  • Python 100.0%