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SMILES should be separated by a ; which will then get or create multiple compounds.
The crystal then gets generated and compounds get assigned to crystals manytomany field...
...
I think.
The text was updated successfully, but these errors were encountered:
pipeline/functions/db_functions.py
Lines 256 to 264 in 220ebc3
SMILES should be separated by a ; which will then get or create multiple compounds.
The crystal then gets generated and compounds get assigned to crystals manytomany field...
...
I think.
The text was updated successfully, but these errors were encountered: