4 citations · 4 across the 1 of their papers we have counts for
5 papers
MS-BART: Unified Modeling of Mass Spectra and Molecules for Structure Elucidation
Yang Han, Pengyu Wang, Kai Yu +2
Mass spectrometry (MS) plays a critical role in molecular identification, significantly advancing scientific discovery. However, structure elucidation from MS data remains challeng…
ChemDFM-R: A Chemical Reasoning LLM Enhanced with Atomized Chemical Knowledge
Zihan Zhao, Ziping Wan, Lu Chen +12
Atomized chemical knowledge, such as functional group information of molecules and reactions, plays a pivotal intermediate role in the reasoning process that connects molecular str…
From Generalist to Specialist: A Survey of Large Language Models for Chemistry
Yang Han, Ziping Wan, Lu Chen +2
Large Language Models (LLMs) have significantly transformed our daily life and established a new paradigm in natural language processing (NLP). However, the predominant pretraining…
SciDFM: A Large Language Model with Mixture-of-Experts for Science
Liangtai Sun, Danyu Luo, Da Ma +7
Recently, there has been a significant upsurge of interest in leveraging large language models (LLMs) to assist scientific discovery. However, most LLMs only focus on general scien…
ChemDFM-X: Towards Large Multimodal Model for Chemistry
Zihan Zhao, Bo Chen, Jingpiao Li +10
Rapid developments of AI tools are expected to offer unprecedented assistance to the research of natural science including chemistry. However, neither existing unimodal task-specif…