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When trust_labelling=False, we are identifying solvents as any molecule that doesn't contribute atoms to the products AND is part of our solvents_set. However, molecules that sometimes act as solvents can other times act as acid/bases; identifying the different role of molecules to this depth is a difficult problem, and beyond the scope of this project.
The text was updated successfully, but these errors were encountered:
When trust_labelling=False, we are identifying solvents as any molecule that doesn't contribute atoms to the products AND is part of our solvents_set. However, molecules that sometimes act as solvents can other times act as acid/bases; identifying the different role of molecules to this depth is a difficult problem, and beyond the scope of this project.
The text was updated successfully, but these errors were encountered: