SpecX is a new large-scale multi-modal spectroscopy benchmark with tiered datasets that supports unified evaluation across specialized models and MLLMs, showing specialized models excel at signal-level tasks while MLLMs are stronger in high-level reasoning but weaker in precise spectral grounding.
Sirius 4: a rapid tool for turning tandem mass spectra into metabolite structure information.Nature methods, 16(4): 299–302, 2019
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SpecX: A Large-Scale Benchmark for Multi-Modal Spectroscopy and Cross-Paradigm Evaluation
SpecX is a new large-scale multi-modal spectroscopy benchmark with tiered datasets that supports unified evaluation across specialized models and MLLMs, showing specialized models excel at signal-level tasks while MLLMs are stronger in high-level reasoning but weaker in precise spectral grounding.