Anchor-based methods are a pivotal approach in handling clustering of large-scale data. However, these methods typically entail two distinct stages: selecting anchor points and constructing an anchor graph. This bifurcation, along with the initialization of anchor points, significantly influences the overall performance of the algorithm. To mitigate these issues, we introduce a novel method termed Anchor-free Clustering based on Anchor Graph Factorization (AFCAGF). AFCAGF innovates in learning the anchor graph, requiring only the computation of pairwise distances between samples. This process, achievable through straightforward optimization, circumvents the necessity for explicit selection of anchor points. More concretely, our approach enhances the Fuzzy k-means clustering algorithm (FKM), introducing a new manifold learning technique that obviates the need for initializing cluster centers. Additionally, we evolve the concept of the membership matrix between cluster centers and samples in FKM into an anchor graph encompassing multiple anchor points and samples. Employing Non-negative Matrix Factorization (NMF) on this anchor graph allows for the direct derivation of cluster labels, thereby eliminating the requirement for further post-processing steps. To solve the method proposed, we implement an alternating optimization algorithm that ensures convergence. Empirical evaluations on various real-world datasets underscore the superior efficacy of our algorithm compared to traditional approaches.

We present sDBSCAN, a scalable density-based clustering algorithm in high dimensions with cosine distance. Utilizing the neighborhood-preserving property of random projections, sDBSCAN can quickly identify core points and their neighborhoods, the primary hurdle of density-based clustering. Theoretically, sDBSCAN outputs a clustering structure similar to DBSCAN under mild conditions with high probability. To further facilitate sDBSCAN, we present sOPTICS, a scalable OPTICS for interactive exploration of the intrinsic clustering structure. We also extend sDBSCAN and sOPTICS to L2, L1, $\chi^2$, and Jensen-Shannon distances via random kernel features. Empirically, sDBSCAN is significantly faster and provides higher accuracy than many other clustering algorithms on real-world million-point data sets. On these data sets, sDBSCAN and sOPTICS run in a few minutes, while the scikit-learn's counterparts demand several hours or cannot run due to memory constraints.

Clustering is a pivotal challenge in unsupervised machine learning and is often investigated through the lens of mixture models. The optimal error rate for recovering cluster labels in Gaussian and sub-Gaussian mixture models involves ad hoc signal-to-noise ratios. Simple iterative algorithms, such as Lloyd's algorithm, attain this optimal error rate. In this paper, we first establish a universal lower bound for the error rate in clustering any mixture model, expressed through a Chernoff divergence, a more versatile measure of model information than signal-to-noise ratios. We then demonstrate that iterative algorithms attain this lower bound in mixture models with sub-exponential tails, notably emphasizing location-scale mixtures featuring Laplace-distributed errors. Additionally, for datasets better modelled by Poisson or Negative Binomial mixtures, we study mixture models whose distributions belong to an exponential family. In such mixtures, we establish that Bregman hard clustering, a variant of Lloyd's algorithm employing a Bregman divergence, is rate optimal.

Clustering of longitudinal data is used to explore common trends among subjects over time for a numeric measurement of interest. Various R packages have been introduced throughout the years for identifying clusters of longitudinal patterns, summarizing the variability in trajectories between subject in terms of one or more trends. We introduce the R package "latrend" as a framework for the unified application of methods for longitudinal clustering, enabling comparisons between methods with minimal coding. The package also serves as an interface to commonly used packages for clustering longitudinal data, including "dtwclust", "flexmix", "kml", "lcmm", "mclust", "mixAK", and "mixtools". This enables researchers to easily compare different approaches, implementations, and method specifications. Furthermore, researchers can build upon the standard tools provided by the framework to quickly implement new cluster methods, enabling rapid prototyping. We demonstrate the functionality and application of the latrend package on a synthetic dataset based on the therapy adherence patterns of patients with sleep apnea.

Imbalanced data, characterized by an unequal distribution of data points across different clusters, poses a challenge for traditional hard and fuzzy clustering algorithms, such as hard K-means (HKM, or Lloyd's algorithm) and fuzzy K-means (FKM, or Bezdek's algorithm). This paper introduces equilibrium K-means (EKM), a novel and simple K-means-type algorithm that alternates between just two steps, yielding significantly improved clustering results for imbalanced data by reducing the tendency of centroids to crowd together in the center of large clusters. We also present a unifying perspective for HKM, FKM, and EKM, showing they are essentially gradient descent algorithms with an explicit relationship to Newton's method. EKM has the same time and space complexity as FKM but offers a clearer physical meaning for its membership definition. We illustrate the performance of EKM on two synthetic and ten real datasets, comparing it to various clustering algorithms, including HKM, FKM, maximum-entropy fuzzy clustering, two FKM variations designed for imbalanced data, and the Gaussian mixture model. The results demonstrate that EKM performs competitively on balanced data while significantly outperforming other techniques on imbalanced data. For high-dimensional data clustering, we demonstrate that a more discriminative representation can be obtained by mapping high-dimensional data via deep neural networks into a low-dimensional, EKM-friendly space. Deep clustering with EKM improves clustering accuracy by 35% on an imbalanced dataset derived from MNIST compared to deep clustering based on HKM.

Subsequence clustering of time series is an essential task in data mining, and interpreting the resulting clusters is also crucial since we generally do not have prior knowledge of the data. Thus, given a large collection of tensor time series consisting of multiple modes, including timestamps, how can we achieve subsequence clustering for tensor time series and provide interpretable insights? In this paper, we propose a new method, Dynamic Multi-network Mining (DMM), that converts a tensor time series into a set of segment groups of various lengths (i.e., clusters) characterized by a dependency network constrained with l1-norm. Our method has the following properties. (a) Interpretable: it characterizes the cluster with multiple networks, each of which is a sparse dependency network of a corresponding non-temporal mode, and thus provides visible and interpretable insights into the key relationships. (b) Accurate: it discovers the clusters with distinct networks from tensor time series according to the minimum description length (MDL). (c) Scalable: it scales linearly in terms of the input data size when solving a non-convex problem to optimize the number of segments and clusters, and thus it is applicable to long-range and high-dimensional tensors. Extensive experiments with synthetic datasets confirm that our method outperforms the state-of-the-art methods in terms of clustering accuracy. We then use real datasets to demonstrate that DMM is useful for providing interpretable insights from tensor time series.

Heat, Ventilation and Air Conditioning (HVAC) systems play a critical role in maintaining a comfortable thermal environment and cost approximately 40% of primary energy usage in the building sector. For smart energy management in buildings, usage patterns and their resulting profiles allow the improvement of control systems with prediction capabilities. However, for large-scale HVAC system management, it is difficult to construct a detailed model for each subsystem. In this paper, a new data-driven room temperature prediction model is proposed based on the k-means clustering method. The proposed data-driven temperature prediction approach extracts the system operation feature through historical data analysis and further simplifies the system-level model to improve generalization and computational efficiency. We evaluate the proposed approach in the real world. The results demonstrated that our approach can significantly reduce modeling time without reducing prediction accuracy.

Clustering is one of the most fundamental tools in data science and machine learning, and k-means clustering is one of the most common such methods. There is a variety of approximate algorithms for the k-means problem, but computing the globally optimal solution is in general NP-hard. In this paper we consider the k-means problem for instances with low dimensional data and formulate it as a structured concave assignment problem. This allows us to exploit the low dimensional structure and solve the problem to global optimality within reasonable time for large data sets with several clusters. The method builds on iteratively solving a small concave problem and a large linear programming problem. This gives a sequence of feasible solutions along with bounds which we show converges to zero optimality gap. The paper combines methods from global optimization theory to accelerate the procedure, and we provide numerical results on their performance.

Unsupervised data representation and visualization using tools from topology is an active and growing field of Topological Data Analysis (TDA) and data science. Its most prominent line of work is based on the so-called Mapper graph, which is a combinatorial graph whose topological structures (connected components, branches, loops) are in correspondence with those of the data itself. While highly generic and applicable, its use has been hampered so far by the manual tuning of its many parameters-among these, a crucial one is the so-called filter: it is a continuous function whose variations on the data set are the main ingredient for both building the Mapper representation and assessing the presence and sizes of its topological structures. However, while a few parameter tuning methods have already been investigated for the other Mapper parameters (i.e., resolution, gain, clustering), there is currently no method for tuning the filter itself. In this work, we build on a recently proposed optimization framework incorporating topology to provide the first filter optimization scheme for Mapper graphs. In order to achieve this, we propose a relaxed and more general version of the Mapper graph, whose convergence properties are investigated. Finally, we demonstrate the usefulness of our approach by optimizing Mapper graph representations on several datasets, and showcasing the superiority of the optimized representation over arbitrary ones.

The integration of artificial intelligence (AI) into daily life, particularly through information retrieval and recommender systems, has necessitated advanced user modeling and profiling techniques to deliver personalized experiences. These techniques aim to construct accurate user representations based on the rich amounts of data generated through interactions with these systems. This paper presents a comprehensive survey of the current state, evolution, and future directions of user modeling and profiling research. We provide a historical overview, tracing the development from early stereotype models to the latest deep learning techniques, and propose a novel taxonomy that encompasses all active topics in this research area, including recent trends. Our survey highlights the paradigm shifts towards more sophisticated user profiling methods, emphasizing implicit data collection, multi-behavior modeling, and the integration of graph data structures. We also address the critical need for privacy-preserving techniques and the push towards explainability and fairness in user modeling approaches. By examining the definitions of core terminology, we aim to clarify ambiguities and foster a clearer understanding of the field by proposing two novel encyclopedic definitions of the main terms. Furthermore, we explore the application of user modeling in various domains, such as fake news detection, cybersecurity, and personalized education. This survey serves as a comprehensive resource for researchers and practitioners, offering insights into the evolution of user modeling and profiling and guiding the development of more personalized, ethical, and effective AI systems.