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Equivariant Graph Hierarchy-Based Neural Networks

Machine Learning 2022-10-18 v2

Abstract

Equivariant Graph neural Networks (EGNs) are powerful in characterizing the dynamics of multi-body physical systems. Existing EGNs conduct flat message passing, which, yet, is unable to capture the spatial/dynamical hierarchy for complex systems particularly, limiting substructure discovery and global information fusion. In this paper, we propose Equivariant Hierarchy-based Graph Networks (EGHNs) which consist of the three key components: generalized Equivariant Matrix Message Passing (EMMP) , E-Pool and E-UpPool. In particular, EMMP is able to improve the expressivity of conventional equivariant message passing, E-Pool assigns the quantities of the low-level nodes into high-level clusters, while E-UpPool leverages the high-level information to update the dynamics of the low-level nodes. As their names imply, both E-Pool and E-UpPool are guaranteed to be equivariant to meet physic symmetry. Considerable experimental evaluations verify the effectiveness of our EGHN on several applications including multi-object dynamics simulation, motion capture, and protein dynamics modeling.

Keywords

Cite

@article{arxiv.2202.10643,
  title  = {Equivariant Graph Hierarchy-Based Neural Networks},
  author = {Jiaqi Han and Wenbing Huang and Tingyang Xu and Yu Rong},
  journal= {arXiv preprint arXiv:2202.10643},
  year   = {2022}
}

Comments

20 pages

R2 v1 2026-06-24T09:49:04.287Z