2 papers
cs.CL2025
ChemOrch: Empowering LLMs with Chemical Intelligence via Synthetic Instructions
Yue Huang, Zhengzhe Jiang, Xiaonan Luo +12
Empowering large language models (LLMs) with chemical intelligence remains a challenge due to the scarcity of high-quality, domain-specific instruction-response datasets and the mi…
cs.AI2025
Artificial Intelligence in Spectroscopy: Advancing Chemistry from Prediction to Generation and Beyond
Kehan Guo, Yili Shen, Gisela Abigail Gonzalez-Montiel +8
The rapid advent of machine learning (ML) and artificial intelligence (AI) has catalyzed major transformations in chemistry, yet the application of these methods to spectroscopic a…