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We introduce PyTorch Geometric High Order (PyGHO), a library for High Order Graph Neural Networks (HOGNNs) that extends PyTorch Geometric (PyG). Unlike ordinary Message Passing Neural Networks (MPNNs) that exchange messages between nodes,…

Machine Learning · Computer Science 2023-11-29 Xiyuan Wang , Muhan Zhang

Memory-based Temporal Graph Neural Networks are powerful tools in dynamic graph representation learning and have demonstrated superior performance in many real-world applications. However, their node memory favors smaller batch sizes to…

Machine Learning · Computer Science 2023-07-18 Hongkuan Zhou , Da Zheng , Xiang Song , George Karypis , Viktor Prasanna

Deep Learning(DL) and Machine Learning(ML) applications are rapidly increasing in recent days. Massive amounts of data are being generated over the internet which can derive meaningful results by the use of ML and DL algorithms. Hardware…

Distributed, Parallel, and Cluster Computing · Computer Science 2023-12-12 Dipesh Gyawali

Graph neural networks (GNNs) have seen extensive application in domains such as social networks, bioinformatics, and recommendation systems. However, the irregularity and sparsity of graph data challenge traditional computing methods, which…

Machine Learning · Computer Science 2025-02-25 Ka Wai Wu

Graph Neural Networks (GNNs) have become popular across a diverse set of tasks in exploring structural relationships between entities. However, due to the highly connected structure of the datasets, distributed training of GNNs on…

Machine Learning · Computer Science 2025-09-08 Arefin Niam , Tevfik Kosar , M S Q Zulkar Nine

Deep graph neural networks (GNNs) have achieved excellent results on various tasks on increasingly large graph datasets with millions of nodes and edges. However, memory complexity has become a major obstacle when training deep GNNs for…

Machine Learning · Computer Science 2022-04-12 Guohao Li , Matthias Müller , Bernard Ghanem , Vladlen Koltun

Graph Transformer is a new architecture that surpasses GNNs in graph learning. While there emerge inspiring algorithm advancements, their practical adoption is still limited, particularly on real-world graphs involving up to millions of…

Distributed, Parallel, and Cluster Computing · Computer Science 2024-07-22 Meng Zhang , Jie Sun , Qinghao Hu , Peng Sun , Zeke Wang , Yonggang Wen , Tianwei Zhang

Full-batch training on Graph Neural Networks (GNN) to learn the structure of large graphs is a critical problem that needs to scale to hundreds of compute nodes to be feasible. It is challenging due to large memory capacity and bandwidth…

Many Graph Neural Network (GNN) training systems have emerged recently to support efficient GNN training. Since GNNs embody complex data dependencies between training samples, the training of GNNs should address distinct challenges…

Machine Learning · Computer Science 2024-03-21 Hao Yuan , Yajiong Liu , Yanfeng Zhang , Xin Ai , Qiange Wang , Chaoyi Chen , Yu Gu , Ge Yu

Training massive-scale deep learning models on datasets spanning tens of terabytes presents critical challenges in hardware utilization and training reproducibility. In this paper, we identify and resolve profound data-loading bottlenecks…

Distributed, Parallel, and Cluster Computing · Computer Science 2026-04-24 Kashish Mittal , Di Yu , Roozbeh Ketabi , Arushi Arora , Brendon Lapp , Peng Zhang

The exponential growth in data has intensified the demand for computational power to train large-scale deep learning models. However, the rapid growth in model size and complexity raises concerns about equal and fair access to computational…

Performance · Computer Science 2026-04-03 Lisan Al Amin , Md Ismail Hossain , Rupak Kumar Das , Mahbubul Islam , Abdulaziz Tabbakh

Large-scale graph training is a notoriously challenging problem for graph neural networks (GNNs). Due to the nature of evolving graph structures into the training process, vanilla GNNs usually fail to scale up, limited by the GPU memory…

Machine Learning · Computer Science 2023-03-02 Keyu Duan , Zirui Liu , Peihao Wang , Wenqing Zheng , Kaixiong Zhou , Tianlong Chen , Xia Hu , Zhangyang Wang

Full-graph training on graph neural networks (GNN) has emerged as a promising training method for its effectiveness. Full-graph training requires extensive memory and computation resources. To accelerate this training process, researchers…

Distributed, Parallel, and Cluster Computing · Computer Science 2023-11-28 Qiange Wang , Yao Chen , Weng-Fai Wong , Bingsheng He

Training Graph Neural Networks (GNNs) on real-world graphs consisting of billions of nodes and edges is quite challenging, primarily due to the substantial memory needed to store the graph and its intermediate node and edge features, and…

Machine Learning · Computer Science 2023-08-08 Kaidi Cao , Rui Deng , Shirley Wu , Edward W Huang , Karthik Subbian , Jure Leskovec

GPUs are currently the platform of choice for training neural networks. However, training a deep neural network (DNN) is a time-consuming process even on GPUs because of the massive number of parameters that have to be learned. As a result,…

Distributed, Parallel, and Cluster Computing · Computer Science 2020-05-29 Behnam Pourghassemi , Chenghao Zhang , Joo Hwan Lee , Aparna Chandramowlishwaran

Distributed training of graph neural networks (GNNs) has become a crucial technique for processing large graphs. Prevalent GNN frameworks are model-centric, necessitating the transfer of massive graph vertex features to GNN models, which…

Distributed, Parallel, and Cluster Computing · Computer Science 2024-09-10 Weijian Chen , Shuibing He , Haoyang Qu , Xuechen Zhang

We develop a PyTorch-based Graph Network Simulator (GNS) that learns physics and predicts the flow behavior of particulate and fluid systems. GNS discretizes the domain with nodes representing a collection of material points and the links…

Machine Learning · Computer Science 2022-11-21 Krishna Kumar , Joseph Vantassel

Graph Convolutional Networks (GCNs), particularly for large-scale graphs, are crucial across numerous domains. However, training distributed full-batch GCNs on large-scale graphs suffers from inefficient memory access patterns and high…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-05-27 Chen Zhuang , Lingqi Zhang , Du Wu , Peng Chen , Jiajun Huang , Xin Liu , Rio Yokota , Nikoli Dryden , Toshio Endo , Satoshi Matsuoka , Mohamed Wahib

Graph Convolutional Neural Network (GCNN) is a popular class of deep learning (DL) models in material science to predict material properties from the graph representation of molecular structures. Training an accurate and comprehensive GCNN…

Machine Learning · Computer Science 2022-07-26 Jong Youl Choi , Pei Zhang , Kshitij Mehta , Andrew Blanchard , Massimiliano Lupo Pasini

Over the past years, great progress has been made in improving the computing power of general-purpose graphics processing units (GPGPUs), which facilitates the prosperity of deep neural networks (DNNs) in multiple fields like computer…

Performance · Computer Science 2019-05-28 Zhenheng Tang , Yuxin Wang , Qiang Wang , Xiaowen Chu