Hi Mike, The InChI API itself is not exposed. The contents of the module are in the documentation along with some explanations of how to call it: http://rdkit.org/docs/source/rdkit.Chem.rdinchi.html
If something is missing there, please let us know. -greg On Tue, Oct 8, 2019 at 5:20 PM <mi...@novadatasolutions.co.uk> wrote: > Dear RdKit users, > I was reading the inchi module docs and I couldn't find methods to call > the InChI API. Are these exposed in RDKit? > It says the default is the standard Inchi. What happens when this > conversion fails? > > Thanks, > Mike > _______________________________________________ > Rdkit-discuss mailing list > Rdkit-discuss@lists.sourceforge.net > https://lists.sourceforge.net/lists/listinfo/rdkit-discuss >
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