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Clustering is a common task in machine learning, but clusters of unlabelled data can be hard to quantify. The application of clustering algorithms in chemistry is often dependant on material representation. Ascertaining the effects of…

Machine Learning · Computer Science 2023-05-29 Samantha Durdy , Michael W. Gaultois , Vladimir Gusev , Danushka Bollegala , Matthew J. Rosseinsky

Clustering is widely used in unsupervised learning to find homogeneous groups of observations within a dataset. However, clustering mixed-type data remains a challenge, as few existing approaches are suited for this task. This study…

Machine Learning · Statistics 2025-11-26 Badih Ghattas , Alvaro Sanchez San-Benito

Principal component analysis, dictionary learning, and auto-encoders are all unsupervised methods for learning representations from a large amount of training data. In all these methods, the higher the dimensions of the input data, the…

Machine Learning · Computer Science 2019-08-27 Thomas Chang , Bahareh Tolooshams , Demba Ba

Combining clustering and representation learning is one of the most promising approaches for unsupervised learning of deep neural networks. However, doing so naively leads to ill posed learning problems with degenerate solutions. In this…

Computer Vision and Pattern Recognition · Computer Science 2020-02-20 Yuki Markus Asano , Christian Rupprecht , Andrea Vedaldi

We propose a deep learning approach for discovering kernels tailored to identifying clusters over sample data. Our neural network produces sample embeddings that are motivated by--and are at least as expressive as--spectral clustering. Our…

Machine Learning · Computer Science 2020-01-03 Chieh Wu , Zulqarnain Khan , Yale Chang , Stratis Ioannidis , Jennifer Dy

In this paper, we focus on the fairness issues regarding unsupervised outlier detection. Traditional algorithms, without a specific design for algorithmic fairness, could implicitly encode and propagate statistical bias in data and raise…

Machine Learning · Computer Science 2021-06-10 Hanyu Song , Peizhao Li , Hongfu Liu

Clustering algorithms have long been the topic of research, representing the more popular side of unsupervised learning. Since clustering analysis is one of the best ways to find some clarity and structure within raw data, this paper…

Machine Learning · Computer Science 2025-11-25 Naitik Gada

Deep graph clustering, which aims to group the nodes of a graph into disjoint clusters with deep neural networks, has achieved promising progress in recent years. However, the existing methods fail to scale to the large graph with million…

Machine Learning · Computer Science 2023-07-17 Yue Liu , Ke Liang , Jun Xia , Sihang Zhou , Xihong Yang , Xinwang Liu , Stan Z. Li

In the face of complex natural images, existing deep clustering algorithms fall significantly short in terms of clustering accuracy when compared to supervised classification methods, making them less practical. This paper introduces an…

Machine Learning · Computer Science 2024-08-13 Qiuyu Zhu , Liheng Hu , Sijin Wang

A widely used paradigm to improve the generalization performance of high-capacity neural models is through the addition of auxiliary unsupervised tasks during supervised training. Tasks such as similarity matching and input reconstruction…

Machine Learning · Computer Science 2022-01-19 Shivin Srivastava , Kenji Kawaguchi , Vaibhav Rajan

This paper presents a new multitask learning framework that learns a shared representation among the tasks, incorporating both task and feature clusters. The jointly-induced clusters yield a shared latent subspace where task relationships…

Machine Learning · Statistics 2017-03-06 Keerthiram Murugesan , Jaime Carbonell , Yiming Yang

Neural network-based clustering has recently gained popularity, and in particular a constrained clustering formulation has been proposed to perform transfer learning and image category discovery using deep learning. The core idea is to…

Computer Vision and Pattern Recognition · Computer Science 2018-06-29 Yen-Chang Hsu , Zhaoyang Lv , Joel Schlosser , Phillip Odom , Zsolt Kira

Deep neural networks have recently achieved state of the art performance thanks to new training algorithms for rapid parameter estimation and new regularization methods to reduce overfitting. However, in practice the network architecture…

Machine Learning · Computer Science 2016-03-04 Minyoung Kim , Luca Rigazio

Convolutional networks are at the center of best-in-class computer vision applications for a wide assortment of undertakings. Since 2014, a profound amount of work began to make better convolutional architectures, yielding generous…

Computer Vision and Pattern Recognition · Computer Science 2021-10-07 Dishant Parikh

Recent years have seen growing interest in learning disentangled representations, in which distinct features, such as size or shape, are represented by distinct neurons. Quantifying the extent to which a given representation is disentangled…

Machine Learning · Computer Science 2023-04-06 Louis Mahon , Lei Shah , Thomas Lukasiewicz

Interactive visualization of embedding projections is a useful technique for understanding data and evaluating machine learning models. Labeling data within these visualizations is critical for interpretation, as labels provide an overview…

Human-Computer Interaction · Computer Science 2025-05-20 Donghao Ren , Fred Hohman , Dominik Moritz

Deep clustering, a method for partitioning complex, high-dimensional data using deep neural networks, presents unique evaluation challenges. Traditional clustering validation measures, designed for low-dimensional spaces, are problematic…

Machine Learning · Statistics 2024-03-25 Zeya Wang , Chenglong Ye

The area of constrained clustering has been extensively explored by researchers and used by practitioners. Constrained clustering formulations exist for popular algorithms such as k-means, mixture models, and spectral clustering but have…

Machine Learning · Computer Science 2019-12-20 Hongjing Zhang , Sugato Basu , Ian Davidson

Deep subspace clustering (DSC) networks based on self-expressive model learn representation matrix, often implemented in terms of fully connected network, in the embedded space. After the learning is finished, representation matrix is used…

Computer Vision and Pattern Recognition · Computer Science 2024-01-31 Lovro Sindičić , Ivica Kopriva

Clustering is a fundamental unsupervised representation learning task with wide application in computer vision and pattern recognition. Deep clustering utilizes deep neural networks to learn latent representation, which is suitable for…

Computer Vision and Pattern Recognition · Computer Science 2023-12-27 Wenhao Wu , Weiwei Wang , Shengjiang Kong