Recently the surprising discovery of the Bootstrap Your Own Latent (BYOL) method by Grill et al. shows the negative term in contrastive loss can be removed if we add the so-called prediction head to the network. This initiated the research of non-contrastive self-supervised learning. It is mysterious why even when there exist trivial collapsed global optimal solutions, neural networks trained by (stochastic) gradient descent can still learn competitive representations. This phenomenon is a typical example of implicit bias in deep learning and remains little understood. In this work, we present our empirical and theoretical discoveries on non-contrastive self-supervised learning. Empirically, we find that when the prediction head is initialized as an identity matrix with only its off-diagonal entries being trainable, the network can learn competitive representations even though the trivial optima still exist in the training objective. Theoretically, we present a framework to understand the behavior of the trainable, but identity-initialized prediction head. Under a simple setting, we characterized the substitution effect and acceleration effect of the prediction head. The substitution effect happens when learning the stronger features in some neurons can substitute for learning these features in other neurons through updating the prediction head. And the acceleration effect happens when the substituted features can accelerate the learning of other weaker features to prevent them from being ignored. These two effects enable the neural networks to learn all the features rather than focus only on learning the stronger features, which is likely the cause of the dimensional collapse phenomenon. To the best of our knowledge, this is also the first end-to-end optimization guarantee for non-contrastive methods using nonlinear neural networks with a trainable prediction head and normalization.

Distribution shift occurs when the test distribution differs from the training distribution, and it can considerably degrade performance of machine learning models deployed in the real world. Temporal shifts -- distribution shifts arising from the passage of time -- often occur gradually and have the additional structure of timestamp metadata. By leveraging timestamp metadata, models can potentially learn from trends in past distribution shifts and extrapolate into the future. While recent works have studied distribution shifts, temporal shifts remain underexplored. To address this gap, we curate Wild-Time, a benchmark of 5 datasets that reflect temporal distribution shifts arising in a variety of real-world applications, including patient prognosis and news classification. On these datasets, we systematically benchmark 13 prior approaches, including methods in domain generalization, continual learning, self-supervised learning, and ensemble learning. We use two evaluation strategies: evaluation with a fixed time split (Eval-Fix) and evaluation with a data stream (Eval-Stream). Eval-Fix, our primary evaluation strategy, aims to provide a simple evaluation protocol, while Eval-Stream is more realistic for certain real-world applications. Under both evaluation strategies, we observe an average performance drop of 20% from in-distribution to out-of-distribution data. Existing methods are unable to close this gap. Code is available at https://wild-time.github.io/.

When there are unlabeled Out-Of-Distribution (OOD) data from other classes, Semi-Supervised Learning (SSL) methods suffer from severe performance degradation and even get worse than merely training on labeled data. In this paper, we empirically analyze Pseudo-Labeling (PL) in class-mismatched SSL. PL is a simple and representative SSL method that transforms SSL problems into supervised learning by creating pseudo-labels for unlabeled data according to the model's prediction. We aim to answer two main questions: (1) How do OOD data influence PL? (2) What is the proper usage of OOD data with PL? First, we show that the major problem of PL is imbalanced pseudo-labels on OOD data. Second, we find that OOD data can help classify In-Distribution (ID) data given their OOD ground truth labels. Based on the findings, we propose to improve PL in class-mismatched SSL with two components -- Re-balanced Pseudo-Labeling (RPL) and Semantic Exploration Clustering (SEC). RPL re-balances pseudo-labels of high-confidence data, which simultaneously filters out OOD data and addresses the imbalance problem. SEC uses balanced clustering on low-confidence data to create pseudo-labels on extra classes, simulating the process of training with ground truth. Experiments show that our method achieves steady improvement over supervised baseline and state-of-the-art performance under all class mismatch ratios on different benchmarks.

We investigate whether self-supervised learning (SSL) can improve online reinforcement learning (RL) from pixels. We extend the contrastive reinforcement learning framework (e.g., CURL) that jointly optimizes SSL and RL losses and conduct an extensive amount of experiments with various self-supervised losses. Our observations suggest that the existing SSL framework for RL fails to bring meaningful improvement over the baselines only taking advantage of image augmentation when the same amount of data and augmentation is used. We further perform evolutionary searches to find the optimal combination of multiple self-supervised losses for RL, but find that even such a loss combination fails to meaningfully outperform the methods that only utilize carefully designed image augmentations. After evaluating these approaches together in multiple different environments including a real-world robot environment, we confirm that no single self-supervised loss or image augmentation method can dominate all environments and that the current framework for joint optimization of SSL and RL is limited. Finally, we conduct the ablation study on multiple factors and demonstrate the properties of representations learned with different approaches.

Travel time estimation from GPS trips is of great importance to order duration, ridesharing, taxi dispatching, etc. However, the dense trajectory is not always available due to the limitation of data privacy and acquisition, while the origin destination (OD) type of data, such as NYC taxi data, NYC bike data, and Capital Bikeshare data, is more accessible. To address this issue, this paper starts to estimate the OD trips travel time combined with the road network. Subsequently, a Multitask Weakly Supervised Learning Framework for Travel Time Estimation (MWSL TTE) has been proposed to infer transition probability between roads segments, and the travel time on road segments and intersection simultaneously. Technically, given an OD pair, the transition probability intends to recover the most possible route. And then, the output of travel time is equal to the summation of all segments' and intersections' travel time in this route. A novel route recovery function has been proposed to iteratively maximize the current route's co occurrence probability, and minimize the discrepancy between routes' probability distribution and the inverse distribution of routes' estimation loss. Moreover, the expected log likelihood function based on a weakly supervised framework has been deployed in optimizing the travel time from road segments and intersections concurrently. We conduct experiments on a wide range of real world taxi datasets in Xi'an and Chengdu and demonstrate our method's effectiveness on route recovery and travel time estimation.

Learning from large amounts of unsupervised data and a small amount of supervision is an important open problem in computer vision. We propose a new semi-supervised learning method, Semantic Positives via Pseudo-Labels (SemPPL), that combines labelled and unlabelled data to learn informative representations. Our method extends self-supervised contrastive learning -- where representations are shaped by distinguishing whether two samples represent the same underlying datum (positives) or not (negatives) -- with a novel approach to selecting positives. To enrich the set of positives, we leverage the few existing ground-truth labels to predict the missing ones through a $k$-nearest neighbours classifier by using the learned embeddings of the labelled data. We thus extend the set of positives with datapoints having the same pseudo-label and call these semantic positives. We jointly learn the representation and predict bootstrapped pseudo-labels. This creates a reinforcing cycle. Strong initial representations enable better pseudo-label predictions which then improve the selection of semantic positives and lead to even better representations. SemPPL outperforms competing semi-supervised methods setting new state-of-the-art performance of $68.5\%$ and $76\%$ top-$1$ accuracy when using a ResNet-$50$ and training on $1\%$ and $10\%$ of labels on ImageNet, respectively. Furthermore, when using selective kernels, SemPPL significantly outperforms previous state-of-the-art achieving $72.3\%$ and $78.3\%$ top-$1$ accuracy on ImageNet with $1\%$ and $10\%$ labels, respectively, which improves absolute $+7.8\%$ and $+6.2\%$ over previous work. SemPPL also exhibits state-of-the-art performance over larger ResNet models as well as strong robustness, out-of-distribution and transfer performance.

An intelligent dialogue system in a multi-turn setting should not only generate the responses which are of good quality, but it should also generate the responses which can lead to long-term success of the dialogue. Although, the current approaches improved the response quality, but they over-look the training signals present in the dialogue data. We can leverage these signals to generate the weakly supervised training data for learning dialog policy and reward estimator, and make the policy take actions (generates responses) which can foresee the future direction for a successful (rewarding) conversation. We simulate the dialogue between an agent and a user (modelled similar to an agent with supervised learning objective) to interact with each other. The agent uses dynamic blocking to generate ranked diverse responses and exploration-exploitation to select among the Top-K responses. Each simulated state-action pair is evaluated (works as a weak annotation) with three quality modules: Semantic Relevant, Semantic Coherence and Consistent Flow. Empirical studies with two benchmarks indicate that our model can significantly out-perform the response quality and lead to a successful conversation on both automatic evaluation and human judgement.

In synchrotron-based Computed Tomography (CT) there is a trade-off between spatial resolution, field of view and speed of positioning and alignment of samples. The problem is even more prominent for high-throughput tomography--an automated setup, capable of scanning large batches of samples without human interaction. As a result, in many applications, only 20-30% of the reconstructed volume contains the actual sample. Such data redundancy clutters the storage and increases processing time. Hence, an automated sample localization becomes an important practical problem. In this work, we describe two self-supervised losses designed for biological CT. We further demonstrate how to employ the uncertainty estimation for sample localization. This approach shows the ability to localize a sample with less than 1.5\% relative error and reduce the used storage by a factor of four. We also show that one of the proposed losses works reasonably well as a pre-training task for the semantic segmentation.

Several recent works have proposed a class of algorithms for the offline reinforcement learning (RL) problem that we will refer to as return-conditioned supervised learning (RCSL). RCSL algorithms learn the distribution of actions conditioned on both the state and the return of the trajectory. Then they define a policy by conditioning on achieving high return. In this paper, we provide a rigorous study of the capabilities and limitations of RCSL, something which is crucially missing in previous work. We find that RCSL returns the optimal policy under a set of assumptions that are stronger than those needed for the more traditional dynamic programming-based algorithms. We provide specific examples of MDPs and datasets that illustrate the necessity of these assumptions and the limits of RCSL. Finally, we present empirical evidence that these limitations will also cause issues in practice by providing illustrative experiments in simple point-mass environments and on datasets from the D4RL benchmark.

Data augmentation techniques are widely used for enhancing the performance of machine learning models by tackling class imbalance issues and data sparsity. State-of-the-art generative language models have been shown to provide significant gains across different NLP tasks. However, their applicability to data augmentation for text classification tasks in few-shot settings have not been fully explored, especially for specialised domains. In this paper, we leverage GPT-2 (Radford A et al, 2019) for generating artificial training instances in order to improve classification performance. Our aim is to analyse the impact the selection process of seed training examples have over the quality of GPT-generated samples and consequently the classifier performance. We perform experiments with several seed selection strategies that, among others, exploit class hierarchical structures and domain expert selection. Our results show that fine-tuning GPT-2 in a handful of label instances leads to consistent classification improvements and outperform competitive baselines. Finally, we show that guiding this process through domain expert selection can lead to further improvements, which opens up interesting research avenues for combining generative models and active learning.