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Building subsurface velocity models is essential to our goals in utilizing seismic data for Earth discovery and exploration, as well as monitoring. With the dawn of machine learning, these velocity models (or, more precisely, their…

地球物理 · 物理学 2024-08-20 Randy Harsuko , Shijun Cheng , Tariq Alkhalifah

Generative modeling of graphs with spatial structure is essential across many applications from computer graphics to spatial genomics. Recent flow-based generative models have achieved impressive results by gradually adding and then…

机器学习 · 计算机科学 2025-07-15 Peter Pao-Huang , Mitchell Black , Xiaojie Qiu

The escalating complexity of network threats and the inherent class imbalance in traffic data present formidable challenges for modern Intrusion Detection Systems (IDS). While Graph Neural Networks (GNNs) excel in modeling topological…

机器学习 · 计算机科学 2026-04-15 Tianxiang Xu , Zhichao Wen , Xinyu Zhao , Qi Hu , Yan Li , Chang Liu

We consider the problem of molecular graph generation using deep models. While graphs are discrete, most existing methods use continuous latent variables, resulting in inaccurate modeling of discrete graph structures. In this work, we…

机器学习 · 计算机科学 2021-06-03 Youzhi Luo , Keqiang Yan , Shuiwang Ji

Retrosynthesis prediction is one of the fundamental challenges in organic chemistry and related fields. The goal is to find reactants molecules that can synthesize product molecules. To solve this task, we propose a new graph-to-graph…

定量方法 · 定量生物学 2022-04-20 Zaiyun Lin , Shiqiu Yin , Lei Shi , Wenbiao Zhou , YingSheng Zhang

Generative networks have made it possible to generate meaningful signals such as images and texts from simple noise. Recently, generative methods based on GAN and VAE were developed for graphs and graph signals. However, the mathematical…

机器学习 · 计算机科学 2019-10-18 Dongmian Zou , Gilad Lerman

The dominant graph-to-sequence transduction models employ graph neural networks for graph representation learning, where the structural information is reflected by the receptive field of neurons. Unlike graph neural networks that restrict…

计算与语言 · 计算机科学 2019-12-03 Deng Cai , Wai Lam

Complex spatial dependencies in transportation networks make traffic prediction extremely challenging. Much existing work is devoted to learning dynamic graph structures among sensors, and the strategy of mining spatial dependencies from…

机器学习 · 计算机科学 2023-12-20 Yujie Li , Zezhi Shao , Yongjun Xu , Qiang Qiu , Zhaogang Cao , Fei Wang

Graph convolutional networks (GCNs) are a widely used method for graph representation learning. We investigate the power of GCNs, as a function of their number of layers, to distinguish between different random graph models on the basis of…

机器学习 · 统计学 2020-02-14 Abram Magner , Mayank Baranwal , Alfred O. Hero

There is a recent surge in the development of spatio-temporal forecasting models in the transportation domain. Long-range traffic forecasting, however, remains a challenging task due to the intricate and extensive spatio-temporal…

机器学习 · 计算机科学 2023-06-02 Zibo Liu , Parshin Shojaee , Chandan K Reddy

Energy-based models for discrete domains, such as graphs, explicitly capture relative likelihoods, naturally enabling composable probabilistic inference tasks like conditional generation or enforcing constraints at test-time. However,…

Short-term traffic flow prediction is a vital branch of the Intelligent Traffic System (ITS) and plays an important role in traffic management. Graph convolution network (GCN) is widely used in traffic prediction models to better deal with…

机器学习 · 计算机科学 2022-05-11 Zhijun Chen , Zhe Lu , Qiushi Chen , Hongliang Zhong , Yishi Zhang , Jie Xue , Chaozhong Wu

As a new approach to train generative models, \emph{generative adversarial networks} (GANs) have achieved considerable success in image generation. This framework has also recently been applied to data with graph structures. We propose…

机器学习 · 计算机科学 2021-02-26 Shuangfei Fan , Bert Huang

Transformers serve as the backbone architectures of Foundational Models, where domain-specific tokenizers allow them to adapt to various domains. Graph Transformers (GTs) have recently emerged as leading models in geometric deep learning,…

神经与进化计算 · 计算机科学 2025-04-03 Limei Wang , Kaveh Hassani , Si Zhang , Dongqi Fu , Baichuan Yuan , Weilin Cong , Zhigang Hua , Hao Wu , Ning Yao , Bo Long

Large-scale data missing is a challenging problem in Intelligent Transportation Systems (ITS). Many studies have been carried out to impute large-scale traffic data by considering their spatiotemporal correlations at a network level. In…

机器学习 · 计算机科学 2023-01-30 Kunpeng Zhang , Lan Wu , Liang Zheng , Na Xie , Zhengbing He

From a telecommunication standpoint, the surge in users and services challenges next-generation networks with escalating traffic demands and limited resources. Accurate traffic prediction can offer network operators valuable insights into…

机器学习 · 计算机科学 2024-05-16 Duc Thinh Ngo , Kandaraj Piamrat , Ons Aouedi , Thomas Hassan , Philippe Raipin-Parvédy

Graph Convolutional Networks (GCNs) achieve great success in non-Euclidean structure data processing recently. In existing studies, deeper layers are used in CCNs to extract deeper features of Euclidean structure data. However, for…

机器学习 · 计算机科学 2022-03-14 Junhua Ma , Jiajun Li , Xueming Li , Xu Li

One significant challenge of exploiting Graph neural networks (GNNs) in real-life scenarios is that they are always treated as black boxes, therefore leading to the requirement of interpretability. To address this, model-level…

机器学习 · 计算机科学 2025-09-22 Xiao Yue , Guangzhi Qu , Lige Gan

Designing molecules with specific properties is a long-lasting research problem and is central to advancing crucial domains such as drug discovery and material science. Recent advances in deep graph generative models treat molecule design…

机器学习 · 计算机科学 2022-03-02 Yuanqi Du , Xiaojie Guo , Amarda Shehu , Liang Zhao

Conditioning image generation on specific features of the desired output is a key ingredient of modern generative models. However, existing approaches lack a general and unified way of representing structural and semantic conditioning at…

计算机视觉与模式识别 · 计算机科学 2024-07-08 Luca Butera , Andrea Cini , Alberto Ferrante , Cesare Alippi