"geometric graph neural networks" Papers

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DualEqui: A Dual-Space Hierarchical Equivariant Network for Large Biomolecules

Junjie Xu, Jiahao Zhang, Mangal Prakash et al.

NEURIPS 2025
4
citations

Pushing the Limits of All-Atom Geometric Graph Neural Networks: Pre-Training, Scaling, and Zero-Shot Transfer

Zihan Pengmei, Zhengyuan Shen, Zichen Wang et al.

ICLR 2025arXiv:2410.21683
5
citations

Size-Generalizable RNA Structure Evaluation by Exploring Hierarchical Geometries

Zongzhao Li, Jiacheng Cen, Wenbing Huang et al.

ICLR 2025

EquiPocket: an E(3)-Equivariant Geometric Graph Neural Network for Ligand Binding Site Prediction

yang zhang, Zhewei Wei, Ye Yuan et al.

ICML 2024arXiv:2302.12177
34
citations