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This paper studies asynchronous message passing (AMP), a new paradigm for applying neural network based learning to graphs. Existing graph neural networks use the synchronous distributed computing model and aggregate their neighbors in each…

Machine Learning · Computer Science 2022-05-25 Lukas Faber , Roger Wattenhofer

Machine learning (ML) is revolutionizing protein structural analysis, including an important subproblem of predicting protein residue contact maps, i.e., which amino-acid residues are in close spatial proximity given the amino-acid sequence…

Quantitative Methods · Quantitative Biology 2022-12-23 Kuang Liu , Rajiv K. Kalia , Xinlian Liu , Aiichiro Nakano , Ken-ichi Nomura , Priya Vashishta , Rafael Zamora-Resendizc

Data-driven neighborhood definitions and graph constructions are often used in machine learning and signal processing applications. k-nearest neighbor~(kNN) and $\epsilon$-neighborhood methods are among the most common methods used for…

Machine Learning · Computer Science 2023-04-18 Sarath Shekkizhar , Antonio Ortega

Recently, there have been some breakthroughs in graph analysis by applying the graph neural networks (GNNs) following a neighborhood aggregation scheme, which demonstrate outstanding performance in many tasks. However, we observe that the…

Machine Learning · Computer Science 2021-04-13 Hanchen Wang , Defu Lian , Ying Zhang , Lu Qin , Xiangjian He , Yiguang Lin , Xuemin Lin

Efficient computation of node proximity queries such as transition probabilities, Personalized PageRank, and Katz are of fundamental importance in various graph mining and learning tasks. In particular, several recent works leverage fast…

Data Structures and Algorithms · Computer Science 2021-11-29 Hanzhi Wang , Mingguo He , Zhewei Wei , Sibo Wang , Ye Yuan , Xiaoyong Du , Ji-Rong Wen

We present a new algorithm for the approximate near neighbor problem that combines classical ideas from group testing with locality-sensitive hashing (LSH). We reduce the near neighbor search problem to a group testing problem by…

Data Structures and Algorithms · Computer Science 2021-06-23 Joshua Engels , Benjamin Coleman , Anshumali Shrivastava

Graph Neural Networks (GNNs) have gained traction in the complex domain of drug discovery because of their ability to process graph-structured data such as drug molecule models. This approach has resulted in a myriad of methods and models…

Machine Learning · Computer Science 2025-09-10 Katherine Berry , Liang Cheng

In recent years, graph neural networks (GNNs) have become increasingly popular for solving NP-hard combinatorial optimization (CO) problems, such as maximum cut and maximum independent set. The core idea behind these methods is to represent…

Machine Learning · Computer Science 2024-06-11 Yang Liu , Peng Zhang , Yang Gao , Chuan Zhou , Zhao Li , Hongyang Chen

$\renewcommand{\Re}{\mathbb{R}}$Recent work showed how to construct nearest-neighbor graphs of linear size, on a given set $P$ of $n$ points in $\Re^d$, such that one can answer approximate nearest-neighbor queries in logarithmic time in…

Computational Geometry · Computer Science 2026-02-10 Jeff Giliberti , Sariel Har-Peled , Jonas Sauer , Ali Vakilian

Neural architecture search enables automation of architecture design. Despite its success, it is computationally costly and does not provide an insight on how to design a desirable architecture. Here we propose a new way of searching neural…

Machine Learning · Computer Science 2021-12-16 Zhenhan Huang , Chunheng Jiang , Pin-Yu Chen , Jianxi Gao

Approximate nearest-neighbor search is a fundamental algorithmic problem that continues to inspire study due its essential role in numerous contexts. In contrast to most prior work, which has focused on point sets, we consider…

Computational Geometry · Computer Science 2021-04-01 Ahmed Abdelkader , David M. Mount

After a period of decrease, interest in word alignments is increasing again for their usefulness in domains such as typological research, cross-lingual annotation projection, and machine translation. Generally, alignment algorithms only use…

Computation and Language · Computer Science 2022-08-11 Ayyoob Imani , Lütfi Kerem Şenel , Masoud Jalili Sabet , François Yvon , Hinrich Schütze

Graph neural architecture search (GraphNAS) has recently aroused considerable attention in both academia and industry. However, two key challenges seriously hinder the further research of GraphNAS. First, since there is no consensus for the…

Machine Learning · Computer Science 2024-03-12 Yijian Qin , Ziwei Zhang , Xin Wang , Zeyang Zhang , Wenwu Zhu

Nearest neighbor (NN) graph based visual re-ranking has emerged as a powerful approach for improving retrieval accuracy, offering the advantages of effectively exploring high-dimensional manifolds without requiring additional fine-tuning.…

Computer Vision and Pattern Recognition · Computer Science 2025-07-09 Jaeyoon Kim , Yoonki Cho , Taeyoung Kim , Sung-Eui Yoon

Approximate nearest neighbor search (ANNS) is a key retrieval technique for vector database and many data center applications, such as person re-identification and recommendation systems. It is also fundamental to retrieval augmented…

Hardware Architecture · Computer Science 2024-05-30 Yitu Wang , Shiyu Li , Qilin Zheng , Linghao Song , Zongwang Li , Andrew Chang , Hai "Helen" Li , Yiran Chen

Community detection is a fundamental problem in machine learning. While deep learning has shown great promise in many graphrelated tasks, developing neural models for community detection has received surprisingly little attention. The few…

Machine Learning · Computer Science 2019-09-27 Oleksandr Shchur , Stephan Günnemann

The exponential growth of data has intensified the gap between the availability of unlabeled data and the high cost of manual annotation. Graph Neural Networks (GNNs) have emerged as a promising solution, as they exploit relational…

Computer Vision and Pattern Recognition · Computer Science 2026-05-26 Rafael Mendonça Duarte , Jean Roberto Ponciano , Lucas Pascotti Valem

Extensive research has been conducted, over recent years, on various ways of enhancing heuristic search for combinatorial optimization problems with machine learning algorithms. In this study, we investigate the use of predictions from…

Neural and Evolutionary Computing · Computer Science 2022-10-24 Ítalo Santana , Andrea Lodi , Thibaut Vidal

The problem of node-similarity in networks has motivated a plethora of such measures between node-pairs, which make use of the underlying graph structure. However, higher-order relations cannot be losslessly captured by mere graphs and…

Social and Information Networks · Computer Science 2021-11-02 Govind Sharma , Paarth Gupta , M. Narasihma Murty

The problem of measuring similarity of graphs and their nodes is important in a range of practical problems. There is a number of proposed measures, some of them being based on iterative calculation of similarity between two graphs and the…

Artificial Intelligence · Computer Science 2010-09-28 Mladen Nikolic