X-MeshGraphNet: Scalable Multi-Scale Graph Neural Networks for Physics Simulation

Fuente: arXiv
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Auteurs principaux: Nabian, Mohammad Amin, Liu, Chang, Ranade, Rishikesh, Choudhry, Sanjay
Format: Preprint
Publié: 2024
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author Nabian, Mohammad Amin
Liu, Chang
Ranade, Rishikesh
Choudhry, Sanjay
author_facet Nabian, Mohammad Amin
Liu, Chang
Ranade, Rishikesh
Choudhry, Sanjay
contents Graph Neural Networks (GNNs) have gained significant traction for simulating complex physical systems, with models like MeshGraphNet demonstrating strong performance on unstructured simulation meshes. However, these models face several limitations, including scalability issues, requirement for meshing at inference, and challenges in handling long-range interactions. In this work, we introduce X-MeshGraphNet, a scalable, multi-scale extension of MeshGraphNet designed to address these challenges. X-MeshGraphNet overcomes the scalability bottleneck by partitioning large graphs and incorporating halo regions that enable seamless message passing across partitions. This, combined with gradient aggregation, ensures that training across partitions is equivalent to processing the entire graph at once. To remove the dependency on simulation meshes, X-MeshGraphNet constructs custom graphs directly from tessellated geometry files (e.g., STLs) by generating point clouds on the surface or volume of the object and connecting k-nearest neighbors. Additionally, our model builds multi-scale graphs by iteratively combining coarse and fine-resolution point clouds, where each level refines the previous, allowing for efficient long-range interactions. Our experiments demonstrate that X-MeshGraphNet maintains the predictive accuracy of full-graph GNNs while significantly improving scalability and flexibility. This approach eliminates the need for time-consuming mesh generation at inference, offering a practical solution for real-time simulation across a wide range of applications. The code for reproducing the results presented in this paper is available through NVIDIA Modulus.
format Preprint
id arxiv_https___arxiv_org_abs_2411_17164
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle X-MeshGraphNet: Scalable Multi-Scale Graph Neural Networks for Physics Simulation
Nabian, Mohammad Amin
Liu, Chang
Ranade, Rishikesh
Choudhry, Sanjay
Machine Learning
Computational Physics
Graph Neural Networks (GNNs) have gained significant traction for simulating complex physical systems, with models like MeshGraphNet demonstrating strong performance on unstructured simulation meshes. However, these models face several limitations, including scalability issues, requirement for meshing at inference, and challenges in handling long-range interactions. In this work, we introduce X-MeshGraphNet, a scalable, multi-scale extension of MeshGraphNet designed to address these challenges. X-MeshGraphNet overcomes the scalability bottleneck by partitioning large graphs and incorporating halo regions that enable seamless message passing across partitions. This, combined with gradient aggregation, ensures that training across partitions is equivalent to processing the entire graph at once. To remove the dependency on simulation meshes, X-MeshGraphNet constructs custom graphs directly from tessellated geometry files (e.g., STLs) by generating point clouds on the surface or volume of the object and connecting k-nearest neighbors. Additionally, our model builds multi-scale graphs by iteratively combining coarse and fine-resolution point clouds, where each level refines the previous, allowing for efficient long-range interactions. Our experiments demonstrate that X-MeshGraphNet maintains the predictive accuracy of full-graph GNNs while significantly improving scalability and flexibility. This approach eliminates the need for time-consuming mesh generation at inference, offering a practical solution for real-time simulation across a wide range of applications. The code for reproducing the results presented in this paper is available through NVIDIA Modulus.
title X-MeshGraphNet: Scalable Multi-Scale Graph Neural Networks for Physics Simulation
topic Machine Learning
Computational Physics
url https://arxiv.org/abs/2411.17164