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pckroon / pysmiles

A lightweight python-only library for reading and writing SMILES strings
Apache License 2.0
147 stars 21 forks source link

EZ Isomerism and R/S chirality continued #45

Closed pckroon closed 1 month ago

pckroon commented 3 months ago

This PR supersedes and continues the work of @fgrunewald in #39

pckroon commented 2 months ago

Alright @fgrunewald , this should be ready for review. I've noted 2 tests for which I would appreciate it if you could take an extra careful look.