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Clustering is a fundamental unsupervised learning task for uncovering patterns in data. While Gaussian Blurring Mean Shift (GBMS) has proven effective for identifying arbitrarily shaped clusters in Euclidean space, it struggles with…

Machine Learning · Computer Science 2025-12-15 Arghya Pratihar , Arnab Seal , Swagatam Das , Inesh Chattopadhyay

Protein-ligand binding prediction is central to virtual screening and affinity ranking, two fundamental tasks in drug discovery. While recent retrieval-based methods embed ligands and protein pockets into Euclidean space for…

Machine Learning · Computer Science 2025-11-25 Jianhui Wang , Wenyu Zhu , Bowen Gao , Xin Hong , Ya-Qin Zhang , Wei-Ying Ma , Yanyan Lan

Distance measures play an important role in shape classification and data analysis problems. Topological distances based on Reeb graphs and persistence diagrams have been employed to obtain effective algorithms in shape matching and scalar…

Machine Learning · Computer Science 2023-03-07 Yashwanth Ramamurthi , Amit Chattopadhyay

Metric learning aims at finding a suitable distance metric over the input space, to improve the performance of distance-based learning algorithms. In high-dimensional settings, it can also serve as dimensionality reduction by imposing a…

Machine Learning · Computer Science 2024-04-16 Efstratios Palias , Ata Kabán

In practice, many medical datasets have an underlying taxonomy defined over the disease label space. However, existing classification algorithms for medical diagnoses often assume semantically independent labels. In this study, we aim to…

Computer Vision and Pattern Recognition · Computer Science 2022-09-14 Zhen Yu , Toan Nguyen , Yaniv Gal , Lie Ju , Shekhar S. Chandra , Lei Zhang , Paul Bonnington , Victoria Mar , Zhiyong Wang , Zongyuan Ge

Most previous heterogeneous graph embedding models represent elements in a heterogeneous graph as vector representations in a low-dimensional Euclidean space. However, because heterogeneous graphs inherently possess complex structures, such…

Machine Learning · Computer Science 2024-04-16 Jongmin Park , Seunghoon Han , Soohwan Jeong , Sungsu Lim

Hyperbolic deep learning leverages the metric properties of hyperbolic spaces to develop efficient and informative embeddings of hierarchical data. Here, we focus on the solvable group structure of hyperbolic spaces, which follows naturally…

Machine Learning · Computer Science 2025-06-02 Federico Milanesio , Matteo Santoro , Pietro G. Fré , Guido Sanguinetti

Hypergraphs are useful mathematical representations of overlapping and nested subsets of interacting units, including groups of genes or brain regions, economic cartels, political or military coalitions, and groups of products that are…

Methodology · Statistics 2026-02-03 Cornelius Fritz , Yubai Yuan , Michael Schweinberger

Current few-shot learning models capture visual object relations in the so-called meta-learning setting under a fixed-resolution input. However, such models have a limited generalization ability under the scale and location mismatch between…

Computer Vision and Pattern Recognition · Computer Science 2022-10-11 Hongguang Zhang , Philip H. S. Torr , Piotr Koniusz

Learning the embedding space, where semantically similar objects are located close together and dissimilar objects far apart, is a cornerstone of many computer vision applications. Existing approaches usually learn a single metric in the…

Computer Vision and Pattern Recognition · Computer Science 2019-06-17 Artsiom Sanakoyeu , Vadim Tschernezki , Uta Büchler , Björn Ommer

Given data, finding a faithful low-dimensional hyperbolic embedding of the data is a key method by which we can extract hierarchical information or learn representative geometric features of the data. In this paper, we explore a new method…

Machine Learning · Computer Science 2020-10-26 Rishi Sonthalia , Anna C. Gilbert

Many well-known and effective anomaly detection methods assume that a reasonable decision boundary has a hypersphere shape, which however is difficult to obtain in practice and is not sufficiently compact, especially when the data are in…

Machine Learning · Computer Science 2024-05-07 Yunhe Zhang , Yan Sun , Jinyu Cai , Jicong Fan

In this work, we propose a fashion item recommendation model that incorporates hyperbolic geometry into user and item representations. Using hyperbolic space, our model aims to capture implicit hierarchies among items based on their visual…

Information Retrieval · Computer Science 2024-09-05 Ryotaro Shimizu , Yu Wang , Masanari Kimura , Yuki Hirakawa , Takashi Wada , Yuki Saito , Julian McAuley

Hypergraphs have been becoming a popular choice to model complex, non-pairwise, and higher-order interactions for recommender system. However, compared with traditional graph-based methods, the constructed hypergraphs are usually much…

Social and Information Networks · Computer Science 2021-08-19 Yicong Li , Hongxu Chen , Xiangguo Sun , Zhenchao Sun , Lin Li , Lizhen Cui , Philip S. Yu , Guandong Xu

Learning low-dimensional numerical representations from symbolic data, e.g., embedding the nodes of a graph into a geometric space, is an important concept in machine learning. While embedding into Euclidean space is common, recent…

Machine Learning · Computer Science 2024-10-10 Thomas Bläsius , Jean-Pierre von der Heydt , Maximilian Katzmann , Nikolai Maas

Supervision for metric learning has long been given in the form of equivalence between human-labeled classes. Although this type of supervision has been a basis of metric learning for decades, we argue that it hinders further advances in…

Computer Vision and Pattern Recognition · Computer Science 2023-04-11 Sungyeon Kim , Boseung Jeong , Suha Kwak

This article proposes an active learning method for high dimensional data, based on intrinsic data geometries learned through diffusion processes on graphs. Diffusion distances are used to parametrize low-dimensional structures on the…

Machine Learning · Computer Science 2019-05-31 Mauro Maggioni , James M. Murphy

To leverage the complex structures within heterogeneous graphs, recent studies on heterogeneous graph embedding use a hyperbolic space, characterized by a constant negative curvature and exponentially increasing space, which aligns with the…

Machine Learning · Computer Science 2025-06-23 Jongmin Park , Seunghoon Han , Jong-Ryul Lee , Sungsu Lim

Hyperbolic space is a geometry that is known to be well-suited for representation learning of data with an underlying hierarchical structure. In this paper, we present a novel hyperbolic distribution called \textit{pseudo-hyperbolic…

Machine Learning · Statistics 2019-05-13 Yoshihiro Nagano , Shoichiro Yamaguchi , Yasuhiro Fujita , Masanori Koyama

The problem of identifying geometric structure in data is a cornerstone of (unsupervised) learning. As a result, Geometric Representation Learning has been widely applied across scientific and engineering domains. In this work, we…

Machine Learning · Computer Science 2025-06-03 Imran Nasim , Melanie Weber
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