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Source arXiv Computation and Language export.arxiv.org Analyst
July 8, 2026 ai_technology research

Where to cut, how deep: BPE and Unigram-LM on chemistry SMILES

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arXiv:2607.05691v1 Announce Type: new Abstract: Every chemical language model reading SMILES begins with a tokenizer, yet the field has inherited byte-pair encoding (BPE) from natural language with little scrutiny. In natural language, BPE's principal alternative, Unigram-LM, is known to build structurally different vocabularies. Whether that contrast survives in chemistry was open. We report a controlled comparison of BPE and Unigram-LM over a fixed 165-token chemistry base, at the small vocabu

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