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Inferring the graph structure from observed data is a key task in graph machine learning to capture the intrinsic relationship between data entities. While significant advancements have been made in learning the structure of homogeneous…

机器学习 · 计算机科学 2025-03-13 Keyue Jiang , Bohan Tang , Xiaowen Dong , Laura Toni

Graph Neural Networks (GNNs) are deep learning models that take graph data as inputs, and they are applied to various tasks such as traffic prediction and molecular property prediction. However, owing to the complexity of the GNNs, it has…

机器学习 · 计算机科学 2021-11-02 Tetsu Kasanishi , Xueting Wang , Toshihiko Yamasaki

Being able to predict the performance of circuits without running expensive simulations is a desired capability that can catalyze automated design. In this paper, we present a supervised pretraining approach to learn circuit representations…

机器学习 · 计算机科学 2022-04-04 Kourosh Hakhamaneshi , Marcel Nassar , Mariano Phielipp , Pieter Abbeel , Vladimir Stojanović

Image segmentation is crucial in many computational pathology pipelines, including accurate disease diagnosis, subtyping, outcome, and survivability prediction. The common approach for training a segmentation model relies on a pre-trained…

计算机视觉与模式识别 · 计算机科学 2025-04-10 Sachin Kumar Danisetty , Alexandros Graikos , Srikar Yellapragada , Dimitris Samaras

Computing shortest path distances between nodes lies at the heart of many graph algorithms and applications. Traditional exact methods such as breadth-first-search (BFS) do not scale up to contemporary, rapidly evolving today's massive…

机器学习 · 计算机科学 2020-02-14 Fatemeh Salehi Rizi , Joerg Schloetterer , Michael Granitzer

We study the diversity of the features learned by a two-layer neural network trained with the least squares loss. We measure the diversity by the average $L_2$-distance between the hidden-layer features and theoretically investigate how…

机器学习 · 计算机科学 2023-06-14 Firas Laakom , Jenni Raitoharju , Alexandros Iosifidis , Moncef Gabbouj

Graph neural networks (GNN) have shown great success in learning from graph-structured data. They are widely used in various applications, such as recommendation, fraud detection, and search. In these domains, the graphs are typically…

机器学习 · 计算机科学 2021-08-04 Da Zheng , Chao Ma , Minjie Wang , Jinjing Zhou , Qidong Su , Xiang Song , Quan Gan , Zheng Zhang , George Karypis

Graph embeddings have emerged as a powerful tool for representing complex network structures in a low-dimensional space, enabling the use of efficient methods that employ the metric structure in the embedding space as a proxy for the…

社会与信息网络 · 计算机科学 2024-04-18 Radosław Nowak , Adam Małkowski , Daniel Cieślak , Piotr Sokół , Paweł Wawrzyński

Distilling high-accuracy Graph Neural Networks (GNNs) to low-latency multilayer perceptions (MLPs) on graph tasks has become a hot research topic. However, conventional MLP learning relies almost exclusively on graph nodes and fails to…

机器学习 · 计算机科学 2024-12-10 Taiqiang Wu , Zhe Zhao , Jiahao Wang , Xingyu Bai , Lei Wang , Ngai Wong , Yujiu Yang

Massive Multiple-Input Multiple-Out (MIMO) detection is an important problem in modern wireless communication systems. While traditional Belief Propagation (BP) detectors perform poorly on loopy graphs, the recent Graph Neural Networks…

信息论 · 计算机科学 2022-06-15 Hongyi Li , Junxiang Wang , Yongchao Wang

Graph-based neural network models are producing strong results in a number of domains, in part because graphs provide flexibility to encode domain knowledge in the form of relational structure (edges) between nodes in the graph. In…

机器学习 · 计算机科学 2020-11-09 Daniel D. Johnson , Hugo Larochelle , Daniel Tarlow

Learning to generate graphs is challenging as a graph is a set of pairwise connected, unordered nodes encoding complex combinatorial structures. Recently, several works have proposed graph generative models based on normalizing flows or…

机器学习 · 计算机科学 2023-06-21 Xiaohui Chen , Yukun Li , Aonan Zhang , Li-Ping Liu

Graph neural networks (GNNs) have received massive attention in the field of machine learning on graphs. Inspired by the success of neural networks, a line of research has been conducted to train GNNs to deal with various tasks, such as…

机器学习 · 计算机科学 2022-04-11 Manh Tuan Do , Noseong Park , Kijung Shin

In modern computer vision, images are typically represented as a fixed uniform grid with some stride and processed via a deep convolutional neural network. We argue that deforming the grid to better align with the high-frequency image…

计算机视觉与模式识别 · 计算机科学 2023-04-05 Jun Gao , Zian Wang , Jinchen Xuan , Sanja Fidler

Large-scale graphs are widely used to represent object relationships in many real world applications. The occurrence of large-scale graphs presents significant computational challenges to process, analyze, and extract information. Graph…

社会与信息网络 · 计算机科学 2019-10-11 Yu Jin , Andreas Loukas , Joseph F. JaJa

In the study of neurons, morphology influences function. The complexity in the structure of neurons poses a challenge in the identification and analysis of similar and dissimilar neuronal cells. Existing methodologies carry out structural…

图像与视频处理 · 电气工程与系统科学 2018-02-21 Tamal Batabyal , Scott T. Acton

Deep learning for molecular science has so far mainly focused on 2D molecular graphs. Recently, however, there has been work to extend it to 3D molecular geometry, due to its scientific significance and critical importance in real-world…

机器学习 · 计算机科学 2022-07-19 Daniel T. Chang

Learning distributions of graphs can be used for automatic drug discovery, molecular design, complex network analysis, and much more. We present an improved framework for learning generative models of graphs based on the idea of deep state…

机器学习 · 计算机科学 2021-12-07 Julian Stier , Michael Granitzer

Graph neural networks (GNNs) often struggle to learn discriminative node representations for heterophilic graphs, where connected nodes tend to have dissimilar labels and feature similarity provides weak structural cues. We propose…

机器学习 · 计算机科学 2025-12-30 Ayushman Raghuvanshi , Gonzalo Mateos , Sundeep Prabhakar Chepuri

Graph Neural Networks (GNNs) have become the de-facto standard tool for modeling relational data. However, while many real-world graphs are directed, the majority of today's GNN models discard this information altogether by simply making…

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