BioinformaticsbioRxivPreprint
MS4MS: LLMs-driven Multi-agent System for Small-molecule Identification via LC-MS/MS
Na Guo, Jianbin Guo, Yizhe Liu…·Hongjun Yang
MS4MS is a multi-agent system using large language models to automate small molecule identification from LC-MS/MS data, achieving state-of-the-art performance and improved interpretability.
DOI 10.64898/2025.12.02.691830