8 citations · 18 across the 14 of their papers we have counts for
3 papers · 1 filter
IR-Agent: Expert-Inspired LLM Agents for Structure Elucidation from Infrared Spectra
Heewoong Noh, Namkyeong Lee, Gyoung S. Na +2
Spectral analysis provides crucial clues for the elucidation of unknown materials. Among various techniques, infrared spectroscopy (IR) plays an important role in laboratory settin…
Thickness-aware E(3)-Equivariant 3D Mesh Neural Networks
Sungwon Kim, Namkyeong Lee, Yunyoung Doh +5
Mesh-based 3D static analysis methods have recently emerged as efficient alternatives to traditional computational numerical solvers, significantly reducing computational costs and…
RAG-Enhanced Collaborative LLM Agents for Drug Discovery
Namkyeong Lee, Edward De Brouwer, Ehsan Hajiramezanali +3
Recent advances in large language models (LLMs) have shown great potential to accelerate drug discovery. However, the specialized nature of biochemical data often necessitates cost…