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Autore principale: Han, Jiatong
Natura: Preprint
Pubblicazione: 2024
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Accesso online:https://arxiv.org/abs/2407.11756
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author Han, Jiatong
author_facet Han, Jiatong
contents We present many-body Message Passing Neural Network (MPNN) framework that models higher-order node interactions ($\ge 2$ nodes). We model higher-order terms as tree-shaped motifs, comprising a central node with its neighborhood, and apply localized spectral filters on motif Laplacian, weighted by global edge Ricci curvatures. We prove our formulation is invariant to neighbor node permutation, derive its sensitivity bound, and bound the range of learned graph potential. We run regression on graph energies to demonstrate that it scales well with deeper and wider network topology, and run classification on synthetic graph datasets with heterophily and show its consistently high Dirichlet energy growth. We open-source our code at https://github.com/JThh/Many-Body-MPNN.
format Preprint
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institution arXiv
publishDate 2024
record_format arxiv
spellingShingle A Theoretical Formulation of Many-body Message Passing Neural Networks
Han, Jiatong
Machine Learning
We present many-body Message Passing Neural Network (MPNN) framework that models higher-order node interactions ($\ge 2$ nodes). We model higher-order terms as tree-shaped motifs, comprising a central node with its neighborhood, and apply localized spectral filters on motif Laplacian, weighted by global edge Ricci curvatures. We prove our formulation is invariant to neighbor node permutation, derive its sensitivity bound, and bound the range of learned graph potential. We run regression on graph energies to demonstrate that it scales well with deeper and wider network topology, and run classification on synthetic graph datasets with heterophily and show its consistently high Dirichlet energy growth. We open-source our code at https://github.com/JThh/Many-Body-MPNN.
title A Theoretical Formulation of Many-body Message Passing Neural Networks
topic Machine Learning
url https://arxiv.org/abs/2407.11756