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- ---
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- license: odc-by
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- ---
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
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+ ---
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+ license: odc-by
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+ task_categories:
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+ - mask-generation
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+ tags:
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+ - chemistry
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+ - smiles
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+ - cheminformatics
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+ pretty_name: SAFE PubChem 10M
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+ size_categories:
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+ - 10M<n<100M
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+ ---
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+
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+ # PubChem 10M - SAFE Dataset
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+
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+ This dataset is derived from the original **PubChem 10M**. SAFE (sequential attachment-based fragment embedding) representations were generated using **safe-mol (0.1.13)**.
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+ ### Dataset Overview:
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+ - **Source:** PubChem 10M
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+ - **SAFE representation:** safe-mol (0.1.13)
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+ - **Total Entries:** **10M SMILES**