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Network embedding is an effective technique to learn the low-dimensional representations of nodes in networks. Real-world networks are usually with multiplex or having multi-view representations from different relations. Recently, there has…

机器学习 · 计算机科学 2022-03-08 Qifan Wang , Yi Fang , Anirudh Ravula , Ruining He , Bin Shen , Jingang Wang , Xiaojun Quan , Dongfang Liu

Convolution is the most time-consuming part in the computation of convolutional neural networks (CNNs), which have achieved great successes in numerous applications. Due to the complex data dependency and the increase in the amount of model…

机器学习 · 计算机科学 2021-01-01 Xiaoyang Zhang , Junmin Xiao , Guangming Tan

Predicting the link between two nodes is a fundamental problem for graph data analytics. In attributed graphs, both the structure and attribute information can be utilized for link prediction. Most existing studies focus on transductive…

机器学习 · 计算机科学 2020-07-17 Yu Hao , Xin Cao , Yixiang Fang , Xike Xie , Sibo Wang

Prediction of protein-ligand complexes for flexible proteins remains still a challenging problem in computational structural biology and drug design. Here we present two novel deep neural network approaches with significant improvement in…

生物大分子 · 定量生物学 2020-08-28 Amr H. Mahmoud , Jonas F. Lill , Markus A. Lill

Despite their simple intuition, convolutions are more tedious to analyze than dense layers, which complicates the transfer of theoretical and algorithmic ideas to convolutions. We simplify convolutions by viewing them as tensor networks…

机器学习 · 计算机科学 2024-10-25 Felix Dangel

The task of link prediction aims to solve the problem of incomplete knowledge caused by the difficulty of collecting facts from the real world. GCNs-based models are widely applied to solve link prediction problems due to their…

人工智能 · 计算机科学 2022-09-07 Shuanglong Yao , Dechang Pi , Junfu Chen , Yufei Liu , Zhiyuan Wu

Relational data are ubiquitous in real-world data applications, e.g., in social network analysis or biological modeling, but networks are nearly always incompletely observed. The state-of-the-art for predicting missing links in the hard…

机器学习 · 计算机科学 2025-08-13 Bisman Singh , Lucy Van Kleunen , Aaron Clauset

Deep learning methods have demonstrated outstanding performances on classification and regression tasks on homogeneous data types (e.g., image, audio, and text data). However, tabular data still pose a challenge, with classic machine…

机器学习 · 计算机科学 2023-11-15 Antonio Briola , Yuanrong Wang , Silvia Bartolucci , Tomaso Aste

We consider a family of deep neural networks consisting of two groups of convolutional layers, a downsampling operator, and a fully connected layer. The network structure depends on two structural parameters which determine the numbers of…

机器学习 · 计算机科学 2021-07-05 Tong Mao , Zhongjie Shi , Ding-Xuan Zhou

Inductive link prediction with knowledge hypergraphs is the task of predicting missing hyperedges involving completely novel entities (i.e., nodes unseen during training). Existing methods for inductive link prediction with knowledge…

机器学习 · 计算机科学 2026-05-11 Xingyue Huang , Mikhail Galkin , Michael M. Bronstein , İsmail İlkan Ceylan

The application of convolutional neural networks (ConvNets) to harness high-content screening images or 2D compound representations is gaining increasing attention in drug discovery. However, existing applications often require large data…

计算机视觉与模式识别 · 计算机科学 2019-06-25 Isidro Cortes Ciriano , Andreas Bender

Social relations are often used to improve recommendation quality when user-item interaction data is sparse in recommender systems. Most existing social recommendation models exploit pairwise relations to mine potential user preferences.…

信息检索 · 计算机科学 2022-03-01 Junliang Yu , Hongzhi Yin , Jundong Li , Qinyong Wang , Nguyen Quoc Viet Hung , Xiangliang Zhang

Reasoning on knowledge graphs is a challenging task because it utilizes observed information to predict the missing one. Particularly, answering complex queries based on first-order logic is one of the crucial tasks to verify learning to…

人工智能 · 计算机科学 2024-10-23 Hang Yin , Zihao Wang , Yangqiu Song

Representing entities and relations in an embedding space is a well-studied approach for machine learning on relational data. Existing approaches, however, primarily focus on improving accuracy and overlook other aspects such as robustness…

机器学习 · 计算机科学 2019-05-03 Pouya Pezeshkpour , Yifan Tian , Sameer Singh

Convolutional networks are powerful visual models that yield hierarchies of features. We show that convolutional networks by themselves, trained end-to-end, pixels-to-pixels, exceed the state-of-the-art in semantic segmentation. Our key…

计算机视觉与模式识别 · 计算机科学 2015-03-10 Jonathan Long , Evan Shelhamer , Trevor Darrell

Representation learning on temporal interaction graphs (TIG) is to model complex networks with the dynamic evolution of interactions arising in a broad spectrum of problems. Existing dynamic embedding methods on TIG discretely update node…

社会与信息网络 · 计算机科学 2021-10-13 Xu Yan , Xiaoliang Fan , Peizhen Yang , Zonghan Wu , Shirui Pan , Longbiao Chen , Yu Zang , Cheng Wang

Link prediction on graphs is a fundamental problem. Subgraph representation learning approaches (SGRLs), by transforming link prediction to graph classification on the subgraphs around the links, have achieved state-of-the-art performance…

机器学习 · 计算机科学 2024-10-21 Paul Louis , Shweta Ann Jacob , Amirali Salehi-Abari

Representation learning on graphs has been gaining attention due to its wide applicability in predicting missing links, and classifying and recommending nodes. Most embedding methods aim to preserve certain properties of the original graph…

社会与信息网络 · 计算机科学 2019-09-13 Palash Goyal , Di Huang , Sujit Rokka Chhetri , Arquimedes Canedo , Jaya Shree , Evan Patterson

Embedding models have shown great power in knowledge graph completion (KGC) task. By learning structural constraints for each training triple, these methods implicitly memorize intrinsic relation rules to infer missing links. However, this…

计算与语言 · 计算机科学 2023-05-24 Rui Li , Xu Chen , Chaozhuo Li , Yanming Shen , Jianan Zhao , Yujing Wang , Weihao Han , Hao Sun , Weiwei Deng , Qi Zhang , Xing Xie

Tackling molecular optimization problems using conventional computational methods is challenging, because the determination of the optimized configuration is known to be an NP-hard problem. Recently, there has been increasing interest in…

应用物理 · 物理学 2021-08-24 Eshan Joshi , Samuel Somuyiwa , Hossein Z. Jooya