This work investigates an important phenomenon in centroid-based deep clustering (DC) algorithms: Performance quickly saturates after a period of rapid early gains. Practitioners commonly address early saturation with periodic reclustering, which we demonstrate to be insufficient to address performance plateaus. We call this phenomenon the "reclustering barrier" and empirically show when the reclustering barrier occurs, what its underlying mechanisms are, and how it is possible to Break the Reclustering Barrier with our algorithm BRB. BRB avoids early over-commitment to initial clusterings and enables continuous adaptation to reinitialized clustering targets while remaining conceptually simple. Applying our algorithm to widely-used centroid-based DC algorithms, we show that (1) BRB consistently improves performance across a wide range of clustering benchmarks, (2) BRB enables training from scratch, and (3) BRB performs competitively against state-of-the-art DC algorithms when combined with a contrastive loss. We release our code and pre-trained models at https://github.com/Probabilistic-and-Interactive-ML/breaking-the-reclustering-barrier .
Foundation vision-language models have enabled remarkable zero-shot transferability of the pre-trained representations to a wide range of downstream tasks. However, to solve a new task, zero-shot transfer still necessitates human guidance to define visual categories that appear in the data. Here, we show that fully unsupervised transfer emerges when searching for the labeling of a dataset that induces maximal margin classifiers in representation spaces of different foundation models. We present TURTLE, a fully unsupervised method that effectively employs this guiding principle to uncover the underlying labeling of a downstream dataset without any supervision and task-specific representation learning. We evaluate TURTLE on a diverse benchmark suite of 26 datasets and show that it achieves new state-of-the-art unsupervised performance. Furthermore, TURTLE, although being fully unsupervised, outperforms zero-shot transfer baselines on a wide range of datasets. In particular, TURTLE matches the average performance of CLIP zero-shot on 26 datasets by employing the same representation space, spanning a wide range of architectures and model sizes. By guiding the search for the underlying labeling using the representation spaces of two foundation models, TURTLE surpasses zero-shot transfer and unsupervised prompt tuning baselines, demonstrating the surprising power and effectiveness of unsupervised transfer.
Current clustering priors for deep latent variable models (DLVMs) require defining the number of clusters a-priori and are susceptible to poor initializations. Addressing these deficiencies could greatly benefit deep learning-based scRNA-seq analysis by performing integration and clustering simultaneously. We adapt the VampPrior (Tomczak & Welling, 2018) into a Dirichlet process Gaussian mixture model, resulting in the VampPrior Mixture Model (VMM), a novel prior for DLVMs. We propose an inference procedure that alternates between variational inference and Empirical Bayes to cleanly distinguish variational and prior parameters. Using the VMM in a Variational Autoencoder attains highly competitive clustering performance on benchmark datasets. Augmenting scVI (Lopez et al., 2018), a popular scRNA-seq integration method, with the VMM significantly improves its performance and automatically arranges cells into biologically meaningful clusters.
Cross-domain few-shot classification (CDFSC) is a challenging and tough task due to the significant distribution discrepancies across different domains. To address this challenge, many approaches aim to learn transferable representations. Multilayer perceptron (MLP) has shown its capability to learn transferable representations in various downstream tasks, such as unsupervised image classification and supervised concept generalization. However, its potential in the few-shot settings has yet to be comprehensively explored. In this study, we investigate the potential of MLP to assist in addressing the challenges of CDFSC. Specifically, we introduce three distinct frameworks incorporating MLP in accordance with three types of few-shot classification methods to verify the effectiveness of MLP. We reveal that MLP can significantly enhance discriminative capabilities and alleviate distribution shifts, which can be supported by our expensive experiments involving 10 baseline models and 12 benchmark datasets. Furthermore, our method even compares favorably against other state-of-the-art CDFSC algorithms.
Deep clustering can optimize representations of instances (i.e., representation learning) and explore the inherent data distribution (i.e., clustering) simultaneously, which demonstrates a superior performance over conventional clustering methods with given features. However, the coupled objective implies a trivial solution that all instances collapse to the uniform features. To tackle the challenge, a two-stage training strategy is developed for decoupling, where it introduces an additional pre-training stage for representation learning and then fine-tunes the obtained model for clustering. Meanwhile, one-stage methods are developed mainly for representation learning rather than clustering, where various constraints for cluster assignments are designed to avoid collapsing explicitly. Despite the success of these methods, an appropriate learning objective tailored for deep clustering has not been investigated sufficiently. In this work, we first show that the prevalent discrimination task in supervised learning is unstable for one-stage clustering due to the lack of ground-truth labels and positive instances for certain clusters in each mini-batch. To mitigate the issue, a novel stable cluster discrimination (SeCu) task is proposed and a new hardness-aware clustering criterion can be obtained accordingly. Moreover, a global entropy constraint for cluster assignments is studied with efficient optimization. Extensive experiments are conducted on benchmark data sets and ImageNet. SeCu achieves state-of-the-art performance on all of them, which demonstrates the effectiveness of one-stage deep clustering. Code is available at \url{https://github.com/idstcv/SeCu}.
We present a new method of self-supervised learning and knowledge distillation based on the multi-views and multi-representations (MV-MR). The MV-MR is based on the maximization of dependence between learnable embeddings from augmented and non-augmented views, jointly with the maximization of dependence between learnable embeddings from augmented view and multiple non-learnable representations from non-augmented view. We show that the proposed method can be used for efficient self-supervised classification and model-agnostic knowledge distillation. Unlike other self-supervised techniques, our approach does not use any contrastive learning, clustering, or stop gradients. MV-MR is a generic framework allowing the incorporation of constraints on the learnable embeddings via the usage of image multi-representations as regularizers. Along this line, knowledge distillation is considered a particular case of such a regularization. MV-MR provides the state-of-the-art performance on the STL10 and ImageNet-1K datasets among non-contrastive and clustering-free methods. We show that a lower complexity ResNet50 model pretrained using proposed knowledge distillation based on the CLIP ViT model achieves state-of-the-art performance on STL10 linear evaluation. The code is available at: https://github.com/vkinakh/mv-mr
Capsule Networks have shown tremendous advancement in the past decade, outperforming the traditional CNNs in various task due to it's equivariant properties. With the use of vector I/O which provides information of both magnitude and direction of an object or it's part, there lies an enormous possibility of using Capsule Networks in unsupervised learning environment for visual representation tasks such as multi class image classification. In this paper, we propose Contrastive Capsule (CoCa) Model which is a Siamese style Capsule Network using Contrastive loss with our novel architecture, training and testing algorithm. We evaluate the model on unsupervised image classification CIFAR-10 dataset and achieve a top-1 test accuracy of 70.50% and top-5 test accuracy of 98.10%. Due to our efficient architecture our model has 31 times less parameters and 71 times less FLOPs than the current SOTA in both supervised and unsupervised learning.
Deep Learning (DL) has shown great promise in the unsupervised task of clustering. That said, while in classical (i.e., non-deep) clustering the benefits of the nonparametric approach are well known, most deep-clustering methods are parametric: namely, they require a predefined and fixed number of clusters, denoted by K. When K is unknown, however, using model-selection criteria to choose its optimal value might become computationally expensive, especially in DL as the training process would have to be repeated numerous times. In this work, we bridge this gap by introducing an effective deep-clustering method that does not require knowing the value of K as it infers it during the learning. Using a split/merge framework, a dynamic architecture that adapts to the changing K, and a novel loss, our proposed method outperforms existing nonparametric methods (both classical and deep ones). While the very few existing deep nonparametric methods lack scalability, we demonstrate ours by being the first to report the performance of such a method on ImageNet. We also demonstrate the importance of inferring K by showing how methods that fix it deteriorate in performance when their assumed K value gets further from the ground-truth one, especially on imbalanced datasets. Our code is available at https://github.com/BGU-CS-VIL/DeepDPM.
The success of language Transformers is primarily attributed to the pretext task of masked language modeling (MLM), where texts are first tokenized into semantically meaningful pieces. In this work, we study masked image modeling (MIM) and indicate the advantages and challenges of using a semantically meaningful visual tokenizer. We present a self-supervised framework iBOT that can perform masked prediction with an online tokenizer. Specifically, we perform self-distillation on masked patch tokens and take the teacher network as the online tokenizer, along with self-distillation on the class token to acquire visual semantics. The online tokenizer is jointly learnable with the MIM objective and dispenses with a multi-stage training pipeline where the tokenizer needs to be pre-trained beforehand. We show the prominence of iBOT by achieving an 82.3% linear probing accuracy and an 87.8% fine-tuning accuracy evaluated on ImageNet-1K. Beyond the state-of-the-art image classification results, we underline emerging local semantic patterns, which helps the models to obtain strong robustness against common corruptions and achieve leading results on dense downstream tasks, eg., object detection, instance segmentation, and semantic segmentation.
We present TWIST, a simple and theoretically explainable self-supervised representation learning method by classifying large-scale unlabeled datasets in an end-to-end way. We employ a siamese network terminated by a softmax operation to produce twin class distributions of two augmented images. Without supervision, we enforce the class distributions of different augmentations to be consistent. However, simply minimizing the divergence between augmentations will cause collapsed solutions, i.e., outputting the same class probability distribution for all images. In this case, no information about the input image is left. To solve this problem, we propose to maximize the mutual information between the input and the class predictions. Specifically, we minimize the entropy of the distribution for each sample to make the class prediction for each sample assertive and maximize the entropy of the mean distribution to make the predictions of different samples diverse. In this way, TWIST can naturally avoid the collapsed solutions without specific designs such as asymmetric network, stop-gradient operation, or momentum encoder. As a result, TWIST outperforms state-of-the-art methods on a wide range of tasks. Especially, TWIST performs surprisingly well on semi-supervised learning, achieving 61.2% top-1 accuracy with 1% ImageNet labels using a ResNet-50 as backbone, surpassing previous best results by an absolute improvement of 6.2%. Codes and pre-trained models are given on: https://github.com/bytedance/TWIST
Cluster discrimination is an effective pretext task for unsupervised representation learning, which often consists of two phases: clustering and discrimination. Clustering is to assign each instance a pseudo label that will be used to learn representations in discrimination. The main challenge resides in clustering since prevalent clustering methods (e.g., k-means) have to run in a batch mode. Besides, there can be a trivial solution consisting of a dominating cluster. To address these challenges, we first investigate the objective of clustering-based representation learning. Based on this, we propose a novel clustering-based pretext task with online \textbf{Co}nstrained \textbf{K}-m\textbf{e}ans (\textbf{CoKe}). Compared with the balanced clustering that each cluster has exactly the same size, we only constrain the minimal size of each cluster to flexibly capture the inherent data structure. More importantly, our online assignment method has a theoretical guarantee to approach the global optimum. By decoupling clustering and discrimination, CoKe can achieve competitive performance when optimizing with only a single view from each instance. Extensive experiments on ImageNet and other benchmark data sets verify both the efficacy and efficiency of our proposal. Code is available at \url{https://github.com/idstcv/CoKe}.
We present Self-Classifier -- a novel self-supervised end-to-end classification learning approach. Self-Classifier learns labels and representations simultaneously in a single-stage end-to-end manner by optimizing for same-class prediction of two augmented views of the same sample. To guarantee non-degenerate solutions (i.e., solutions where all labels are assigned to the same class) we propose a mathematically motivated variant of the cross-entropy loss that has a uniform prior asserted on the predicted labels. In our theoretical analysis, we prove that degenerate solutions are not in the set of optimal solutions of our approach. Self-Classifier is simple to implement and scalable. Unlike other popular unsupervised classification and contrastive representation learning approaches, it does not require any form of pre-training, expectation-maximization, pseudo-labeling, external clustering, a second network, stop-gradient operation, or negative pairs. Despite its simplicity, our approach sets a new state of the art for unsupervised classification of ImageNet; and even achieves comparable to state-of-the-art results for unsupervised representation learning. Code is available at https://github.com/elad-amrani/self-classifier.
Unsupervised image clustering methods often introduce alternative objectives to indirectly train the model and are subject to faulty predictions and overconfident results. To overcome these challenges, the current research proposes an innovative model RUC that is inspired by robust learning. RUC's novelty is at utilizing pseudo-labels of existing image clustering models as a noisy dataset that may include misclassified samples. Its retraining process can revise misaligned knowledge and alleviate the overconfidence problem in predictions. The model's flexible structure makes it possible to be used as an add-on module to other clustering methods and helps them achieve better performance on multiple datasets. Extensive experiments show that the proposed model can adjust the model confidence with better calibration and gain additional robustness against adversarial noise.
Unsupervised learning has always been appealing to machine learning researchers and practitioners, allowing them to avoid an expensive and complicated process of labeling the data. However, unsupervised learning of complex data is challenging, and even the best approaches show much weaker performance than their supervised counterparts. Self-supervised deep learning has become a strong instrument for representation learning in computer vision. However, those methods have not been evaluated in a fully unsupervised setting. In this paper, we propose a simple scheme for unsupervised classification based on self-supervised representations. We evaluate the proposed approach with several recent self-supervised methods showing that it achieves competitive results for ImageNet classification (39% accuracy on ImageNet with 1000 clusters and 46% with overclustering). We suggest adding the unsupervised evaluation to a set of standard benchmarks for self-supervised learning. The code is available at https://github.com/Randl/kmeans_selfsuper
Unsupervised feature learning has made great strides with contrastive learning based on instance discrimination and invariant mapping, as benchmarked on curated class-balanced datasets. However, natural data could be highly correlated and long-tail distributed. Natural between-instance similarity conflicts with the presumed instance distinction, causing unstable training and poor performance. Our idea is to discover and integrate between-instance similarity into contrastive learning, not directly by instance grouping, but by cross-level discrimination (CLD) between instances and local instance groups. While invariant mapping of each instance is imposed by attraction within its augmented views, between-instance similarity could emerge from common repulsion against instance groups. Our batch-wise and cross-view comparisons also greatly improve the positive/negative sample ratio of contrastive learning and achieve better invariant mapping. To effect both grouping and discrimination objectives, we impose them on features separately derived from a shared representation. In addition, we propose normalized projection heads and unsupervised hyper-parameter tuning for the first time. Our extensive experimentation demonstrates that CLD is a lean and powerful add-on to existing methods such as NPID, MoCo, InfoMin, and BYOL on highly correlated, long-tail, or balanced datasets. It not only achieves new state-of-the-art on self-supervision, semi-supervision, and transfer learning benchmarks, but also beats MoCo v2 and SimCLR on every reported performance attained with a much larger compute. CLD effectively brings unsupervised learning closer to natural data and real-world applications. Our code is publicly available at: https://github.com/frank-xwang/CLD-UnsupervisedLearning.
Deep clustering against self-supervised learning is a very important and promising direction for unsupervised visual representation learning since it requires little domain knowledge to design pretext tasks. However, the key component, embedding clustering, limits its extension to the extremely large-scale dataset due to its prerequisite to save the global latent embedding of the entire dataset. In this work, we aim to make this framework more simple and elegant without performance decline. We propose an unsupervised image classification framework without using embedding clustering, which is very similar to standard supervised training manner. For detailed interpretation, we further analyze its relation with deep clustering and contrastive learning. Extensive experiments on ImageNet dataset have been conducted to prove the effectiveness of our method. Furthermore, the experiments on transfer learning benchmarks have verified its generalization to other downstream tasks, including multi-label image classification, object detection, semantic segmentation and few-shot image classification.
Recent advances in image clustering typically focus on learning better deep representations. In contrast, we present an orthogonal approach that does not rely on abstract features but instead learns to predict image transformations and performs clustering directly in image space. This learning process naturally fits in the gradient-based training of K-means and Gaussian mixture model, without requiring any additional loss or hyper-parameters. It leads us to two new deep transformation-invariant clustering frameworks, which jointly learn prototypes and transformations. More specifically, we use deep learning modules that enable us to resolve invariance to spatial, color and morphological transformations. Our approach is conceptually simple and comes with several advantages, including the possibility to easily adapt the desired invariance to the task and a strong interpretability of both cluster centers and assignments to clusters. We demonstrate that our novel approach yields competitive and highly promising results on standard image clustering benchmarks. Finally, we showcase its robustness and the advantages of its improved interpretability by visualizing clustering results over real photograph collections.
Can we automatically group images into semantically meaningful clusters when ground-truth annotations are absent? The task of unsupervised image classification remains an important, and open challenge in computer vision. Several recent approaches have tried to tackle this problem in an end-to-end fashion. In this paper, we deviate from recent works, and advocate a two-step approach where feature learning and clustering are decoupled. First, a self-supervised task from representation learning is employed to obtain semantically meaningful features. Second, we use the obtained features as a prior in a learnable clustering approach. In doing so, we remove the ability for cluster learning to depend on low-level features, which is present in current end-to-end learning approaches. Experimental evaluation shows that we outperform state-of-the-art methods by large margins, in particular +26.6% on CIFAR10, +25.0% on CIFAR100-20 and +21.3% on STL10 in terms of classification accuracy. Furthermore, our method is the first to perform well on a large-scale dataset for image classification. In particular, we obtain promising results on ImageNet, and outperform several semi-supervised learning methods in the low-data regime without the use of any ground-truth annotations. The code is made publicly available at https://github.com/wvangansbeke/Unsupervised-Classification.
We present a novel clustering objective that learns a neural network classifier from scratch, given only unlabelled data samples. The model discovers clusters that accurately match semantic classes, achieving state-of-the-art results in eight unsupervised clustering benchmarks spanning image classification and segmentation. These include STL10, an unsupervised variant of ImageNet, and CIFAR10, where we significantly beat the accuracy of our closest competitors by 6.6 and 9.5 absolute percentage points respectively. The method is not specialised to computer vision and operates on any paired dataset samples; in our experiments we use random transforms to obtain a pair from each image. The trained network directly outputs semantic labels, rather than high dimensional representations that need external processing to be usable for semantic clustering. The objective is simply to maximise mutual information between the class assignments of each pair. It is easy to implement and rigorously grounded in information theory, meaning we effortlessly avoid degenerate solutions that other clustering methods are susceptible to. In addition to the fully unsupervised mode, we also test two semi-supervised settings. The first achieves 88.8% accuracy on STL10 classification, setting a new global state-of-the-art over all existing methods (whether supervised, semi-supervised or unsupervised). The second shows robustness to 90% reductions in label coverage, of relevance to applications that wish to make use of small amounts of labels. github.com/xu-ji/IIC
Clustering is central to many data-driven application domains and has been studied extensively in terms of distance functions and grouping algorithms. Relatively little work has focused on learning representations for clustering. In this paper, we propose Deep Embedded Clustering (DEC), a method that simultaneously learns feature representations and cluster assignments using deep neural networks. DEC learns a mapping from the data space to a lower-dimensional feature space in which it iteratively optimizes a clustering objective. Our experimental evaluations on image and text corpora show significant improvement over state-of-the-art methods.