The RDKit tests that are part of the repo are more targeted than that; instead of a large collection of files, we tend to have individual files that target specific bits of functionality.
In general: Large collections of mol files are very easy to find (ChEMBL, PubChem, etc.), I think RXNs are harder. What are you looking to be able to do? -greg On Wed, Feb 27, 2019 at 2:30 PM tech tech <computerset...@gmail.com> wrote: > Hi, > > Does rdkit have a test database with a large number of mol files? Or a > large number of RXN files? > > > Thanks, > > Tom > > > _______________________________________________ > Rdkit-discuss mailing list > Rdkit-discuss@lists.sourceforge.net > https://lists.sourceforge.net/lists/listinfo/rdkit-discuss >
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