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I've noticed a potential error in the acs.csv file where the SMILES for the molecule in real/acs/101.png does not seem to match the corresponding image. The SMILES string provided is "O=C1C(SC2=CC=CC=C2)=CSC3=C1C=CC=C3", but the image depicts a molecule that appears to correspond to a different SMILES string:
Based on the image, the correct SMILES should likely be ”O=C1C(SC2=CC=CC=C2)=COC3=CC=CC=C13“. Could you please verify this?
The text was updated successfully, but these errors were encountered:
Hi there, thanks for your great work!
I've noticed a potential error in the
acs.csv
file where the SMILES for the molecule inreal/acs/101.png
does not seem to match the corresponding image. The SMILES string provided is "O=C1C(SC2=CC=CC=C2)=CSC3=C1C=CC=C3", but the image depicts a molecule that appears to correspond to a different SMILES string:Based on the image, the correct SMILES should likely be ”O=C1C(SC2=CC=CC=C2)=COC3=CC=CC=C13“. Could you please verify this?
The text was updated successfully, but these errors were encountered: