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Register a new userUnderstanding the Behaviour of Contrastive Loss
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Feng Wang
Publication date
2020
fields
Informatics Engineering
and research's language is
English
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Unsupervised contrastive learning has achieved outstanding success, while the mechanism of contrastive loss has been less studied. In this paper, we concentrate on the understanding of the behaviours of unsupervised contrastive loss. We will show that the contrastive loss is a hardness-aware loss function, and the temperature {tau} controls the strength of penalties on hard negative samples. The previous study has shown that uniformity is a key property of contrastive learning. We build relations between the uniformity and the temperature {tau} . We will show that uniformity helps the contrastive learning to learn separable features, however excessive pursuit to the uniformity makes the contrastive loss not tolerant to semantically similar samples, which may break the underlying semantic structure and be harmful to the formation of features useful for downstream tasks. This is caused by the inherent defect of the instance discrimination objective. Specifically, instance discrimination objective tries to push all different instances apart, ignoring the underlying relations between samples. Pushing semantically consistent samples apart has no positive effect for acquiring a prior informative to general downstream tasks. A well-designed contrastive loss should have some extents of tolerance to the closeness of semantically similar samples. Therefore, we find that the contrastive loss meets a uniformity-tolerance dilemma, and a good choice of temperature can compromise these two properties properly to both learn separable features and tolerant to semantically similar samples, improving the feature qualities and the downstream performances.
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In deep learning, it is usually assumed that the optimization process is conducted on a shape-fixed loss surface. Differently, we first propose a novel concept of deformation mapping in this paper to affect the behaviour of the optimizer. Vertical deformation mapping (VDM), as a type of deformation mapping, can make the optimizer enter a flat region, which often implies better generalization performance. Moreover, we design various VDMs, and further provide their contributions to the loss surface. After defining the local M region, theoretical analyses show that deforming the loss surface can enhance the gradient descent optimizers ability to filter out sharp minima. With visualizations of loss landscapes, we evaluate the flatnesses of minima obtained by both the original optimizer and optimizers enhanced by VDMs on CIFAR-100. The experimental results show that VDMs do find flatter regions. Moreover, we compare popular convolutional neural networks enhanced by VDMs with the corresponding original ones on ImageNet, CIFAR-10, and CIFAR-100. The results are surprising: there are significant improvements on all of the involved models equipped with VDMs. For example, the top-1 test accuracy of ResNet-20 on CIFAR-100 increases by 1.46%, with insignificant additional computational overhead.
Learning invariant representations is a critical first step in a number of machine learning tasks. A common approach corresponds to the so-called information bottleneck principle in which an application dependent function of mutual information is carefully chosen and optimized. Unfortunately, in practice, these functions are not suitable for optimization purposes since these losses are agnostic of the metric structure of the parameters of the model. We introduce a class of losses for learning representations that are invariant to some extraneous variable of interest by inverting the class of contrastive losses, i.e., inverse contrastive loss (ICL). We show that if the extraneous variable is binary, then optimizing ICL is equivalent to optimizing a regularized MMD divergence. More generally, we also show that if we are provided a metric on the sample space, our formulation of ICL can be decomposed into a sum of convex functions of the given distance metric. Our experimental results indicate that models obtained by optimizing ICL achieve significantly better invariance to the extraneous variable for a fixed desired level of accuracy. In a variety of experimental settings, we show applicability of ICL for learning invariant representations for both continuous and discrete extraneous variables.
How can neural networks trained by contrastive learning extract features from the unlabeled data? Why does contrastive learning usually need much stronger data augmentations than supervised learning to ensure good representations? These questions involve both the optimization and statistical aspects of deep learning, but can hardly be answered by analyzing supervised learning, where the target functions are the highest pursuit. Indeed, in self-supervised learning, it is inevitable to relate to the optimization/generalization of neural networks to how they can encode the latent structures in the data, which we refer to as the feature learning process. In this work, we formally study how contrastive learning learns the feature representations for neural networks by analyzing its feature learning process. We consider the case where our data are comprised of two types of features: the more semantically aligned sparse features which we want to learn from, and the other dense features we want to avoid. Theoretically, we prove that contrastive learning using $mathbf{ReLU}$ networks provably learns the desired sparse features if proper augmentations are adopted. We present an underlying principle called $textbf{feature decoupling}$ to explain the effects of augmentations, where we theoretically characterize how augmentations can reduce the correlations of dense features between positive samples while keeping the correlations of sparse features intact, thereby forcing the neural networks to learn from the self-supervision of sparse features. Empirically, we verified that the feature decoupling principle matches the underlying mechanism of contrastive learning in practice.
While contrastive approaches of self-supervised learning (SSL) learn representations by minimizing the distance between two augmented views of the same data point (positive pairs) and maximizing views from different data points (negative pairs), recent emph{non-contrastive} SSL (e.g., BYOL and SimSiam) show remarkable performance {it without} negative pairs, with an extra learnable predictor and a stop-gradient operation. A fundamental question arises: why do these methods not collapse into trivial representations? We answer this question via a simple theoretical study and propose a novel approach, DirectPred, that emph{directly} sets the linear predictor based on the statistics of its inputs, without gradient training. On ImageNet, it performs comparably with more complex two-layer non-linear predictors that employ BatchNorm and outperforms a linear predictor by $2.5%$ in 300-epoch training (and $5%$ in 60-epoch). DirectPred is motivated by our theoretical study of the nonlinear learning dynamics of non-contrastive SSL in simple linear networks. Our study yields conceptual insights into how non-contrastive SSL methods learn, how they avoid representational collapse, and how multiple factors, like predictor networks, stop-gradients, exponential moving averages, and weight decay all come into play. Our simple theory recapitulates the results of real-world ablation studies in both STL-10 and ImageNet. Code is released https://github.com/facebookresearch/luckmatters/tree/master/ssl.
Contrastive learning (CL) has recently emerged as an effective approach to learning representation in a range of downstream tasks. Central to this approach is the selection of positive (similar) and negative (dissimilar) sets to provide the model the opportunity to `contrast between data and class representation in the latent space. In this paper, we investigate CL for improving model robustness using adversarial samples. We first designed and performed a comprehensive study to understand how adversarial vulnerability behaves in the latent space. Based on these empirical evidences, we propose an effective and efficient supervised contrastive learning to achieve model robustness against adversarial attacks. Moreover, we propose a new sample selection strategy that optimizes the positive/negative sets by removing redundancy and improving correlation with the anchor. Experiments conducted on benchmark datasets show that our Adversarial Supervised Contrastive Learning (ASCL) approach outperforms the state-of-the-art defenses by $2.6%$ in terms of the robust accuracy, whilst our ASCL with the proposed selection strategy can further gain $1.4%$ improvement with only $42.8%$ positives and $6.3%$ negatives compared with ASCL without a selection strategy.
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