Nicholas Aksamit commited on
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Create README.md

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+ ---
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+ tags:
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+ - chemistry
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+ - biology
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+ size_categories:
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+ - 100M<n<1B
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+ ---
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+
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+ 114,218,565 samples.
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+
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+ Contains only the unique, RDKit canonicalized SMILES molecules in a CSV format (after extracting), from the PubChem dataset found at https://ftp.ncbi.nlm.nih.gov/pubchem/Compound/CURRENT-Full/. PubChem compounds collected in 30 April 2023.