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Ethan J. Mick

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Jul 2026

Data Fusion and Contrastive Alignment for Unconstrained IR Molecular Structure Elucidation

Automated molecular structure elucidation from infrared (IR) spectroscopy data has seen significant advancements in recent years, but its broad applicability is limited by a reliance on pre-determined chemical formulas provided as auxiliary model inputs. This limits model predictions to isomer identification rather tha...

Ethan J. Mick, C. Sweet, Matthias J. Young et al. · 0 citations

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