conftrace_

molecular structure elucidation

2 papers

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Co-occurring keywords · papers mentioning both

chemical reasoning (2) spectral data (2) large language model (1) chemical knowledge (1) test-time scaling (1) multi-step reasoning (1) reward model (1) monte carlo tree search (1) spectral analysis (1) knowledge base (1)

Papers

Boosting LLM’s Molecular Structure Elucidation with Knowledge Enhanced Tree Search Reasoning ACL 2025 Can LLMs Solve Molecule Puzzles? A Multimodal Benchmark for Molecular Structure Elucidation NeurIPS 2024