Periodic Graph

Periodic graphs, representing structures with repeating patterns like crystals or polymers, are a focus of current research aiming to develop efficient and accurate methods for their representation and analysis. Researchers are exploring novel graph neural network architectures, including transformer-based models and message-passing networks, designed to capture both local and global periodic information within these structures, often incorporating self-supervised learning techniques to improve data efficiency and generalization. This work has significant implications for materials science, where accurate prediction of material properties from their crystal structures is crucial, and also for other fields like polymer science and neuroscience, where understanding periodic patterns is key to unlocking deeper insights.

Papers