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"Invalid SMILES are beneficial rather than detrimental to chemical language models" in this open-access article in Nature Machine Intelligence https://t.co/Ye8U9r3fAG
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RT @skinniderlab: Very happy to share this work testing a widespread assumption in chemical AI and showing that invalid SMILES are a featur…
4 followers
RT @skinniderlab: Very happy to share this work testing a widespread assumption in chemical AI and showing that invalid SMILES are a featur…