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nielsr/MS-GPT-MassSpecGym

MS-GPT MassSpecGym benchmark data This repository contains the MassSpecGym benchmark files and labels released with MS-GPT: Rethinking MS/MS De Novo Structure Elucidation as Spectrum-Induced Posterior Querying of a Molecule-Language Model. Provenance and attribution These files are mirrored from the authors' released MS-GPT asset bundle with their explicit authorization. Original repository: https://github.com/VIKI623/MS-GPT Author's Hugging Face profile:… See the full description on the dataset page: https://huggingface.co/datasets/nielsr/MS-GPT-MassSpecGym.

Author / organizationnielsr
License (as declared)mit
Downloads217 (as reported by Hugging Face)
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Created30 July 2026
Last updated at source30 July 2026
chemistrymass-spectrometrymolecule-generationms-gpt
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