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spectroscopic analysis

2 papers

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Co-occurring keywords · papers mentioning both

foundation model (2) spectrum prediction (1) transformer model (1) graph neural network (1) molecular structure (1) multimodal spectroscopy (1) structure elucidation (1) chemical analysis (1) molecular property prediction (1) machine learning (1)

Papers

Artificial Intelligence in Spectroscopy: Advancing Chemistry from Prediction To Generation and Beyond IJCAI 2025 Unraveling Molecular Structure: A Multimodal Spectroscopic Dataset for Chemistry NeurIPS 2024