2 papers
cs.LG2025
OXtal: An All-Atom Diffusion Model for Organic Crystal Structure Prediction
Emily Jin, Andrei Cristian Nica, Mikhail Galkin +8
Accurately predicting experimentally realizable 3D molecular crystal structures from their 2D chemical graphs is a long-standing open challenge in computational chemistry called cr…
cs.MA2025
AgentsNet: Coordination and Collaborative Reasoning in Multi-Agent LLMs
Florian Grötschla, Luis Müller, Jan Tönshoff +2
Large-language models (LLMs) have demonstrated powerful problem-solving capabilities, in particular when organized in multi-agent systems. However, the advent of such systems also…