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 Maennel, Hartmut


E3x: $\mathrm{E}(3)$-Equivariant Deep Learning Made Easy

arXiv.org Artificial Intelligence

This work introduces E3x, a software package for building neural networks that are equivariant with respect to the Euclidean group $\mathrm{E}(3)$, consisting of translations, rotations, and reflections of three-dimensional space. Compared to ordinary neural networks, $\mathrm{E}(3)$-equivariant models promise benefits whenever input and/or output data are quantities associated with three-dimensional objects. This is because the numeric values of such quantities (e.g. positions) typically depend on the chosen coordinate system. Under transformations of the reference frame, the values change predictably, but the underlying rules can be difficult to learn for ordinary machine learning models. With built-in $\mathrm{E}(3)$-equivariance, neural networks are guaranteed to satisfy the relevant transformation rules exactly, resulting in superior data efficiency and accuracy. The code for E3x is available from https://github.com/google-research/e3x, detailed documentation and usage examples can be found on https://e3x.readthedocs.io.


Deep Learning Through the Lens of Example Difficulty

arXiv.org Machine Learning

Existing work on understanding deep learning often employs measures that compress all data-dependent information into a few numbers. In this work, we adopt a perspective based on the role of individual examples. We introduce a measure of the computational difficulty of making a prediction for a given input: the (effective) prediction depth. Our extensive investigation reveals surprising yet simple relationships between the prediction depth of a given input and the model's uncertainty, confidence, accuracy and speed of learning for that data point. We further categorize difficult examples into three interpretable groups, demonstrate how these groups are processed differently inside deep models and showcase how this understanding allows us to improve prediction accuracy. Insights from our study lead to a coherent view of a number of separately reported phenomena in the literature: early layers generalize while later layers memorize; early layers converge faster and networks learn easy data and simple functions first.


What Do Neural Networks Learn When Trained With Random Labels?

arXiv.org Machine Learning

We study deep neural networks (DNNs) trained on natural image data with entirely random labels. Despite its popularity in the literature, where it is often used to study memorization, generalization, and other phenomena, little is known about what DNNs learn in this setting. In this paper, we show analytically for convolutional and fully connected networks that an alignment between the principal components of network parameters and data takes place when training with random labels. We study this alignment effect by investigating neural networks pre-trained on randomly labelled image data and subsequently fine-tuned on disjoint datasets with random or real labels. We show how this alignment produces a positive transfer: networks pre-trained with random labels train faster downstream compared to training from scratch even after accounting for simple effects, such as weight scaling. We analyze how competing effects, such as specialization at later layers, may hide the positive transfer. These effects are studied in several network architectures, including VGG16 and ResNet18, on CIFAR10 and ImageNet.


Adaptive Temporal-Difference Learning for Policy Evaluation with Per-State Uncertainty Estimates

arXiv.org Artificial Intelligence

We consider the core reinforcement-learning problem of on-policy value function approximation from a batch of trajectory data, and focus on various issues of Temporal Difference (TD) learning and Monte Carlo (MC) policy evaluation. The two methods are known to achieve complementary bias-variance trade-off properties, with TD tending to achieve lower variance but potentially higher bias. In this paper, we argue that the larger bias of TD can be a result of the amplification of local approximation errors. We address this by proposing an algorithm that adaptively switches between TD and MC in each state, thus mitigating the propagation of errors. Our method is based on learned confidence intervals that detect biases of TD estimates. We demonstrate in a variety of policy evaluation tasks that this simple adaptive algorithm performs competitively with the best approach in hindsight, suggesting that learned confidence intervals are a powerful technique for adapting policy evaluation to use TD or MC returns in a data-driven way.


Temporal Difference Learning with Neural Networks - Study of the Leakage Propagation Problem

arXiv.org Machine Learning

Temporal-Difference learning (TD) [Sutton, 1988] with function approximation can converge to solutions that are worse than those obtained by Monte-Carlo regression, even in the simple case of on-policy evaluation. To increase our understanding of the problem, we investigate the issue of approximation errors in areas of sharp discontinuities of the value function being further propagated by bootstrap updates. We show empirical evidence of this leakage propagation, and show analytically that it must occur, in a simple Markov chain, when function approximation errors are present. For reversible policies, the result can be interpreted as the tension between two terms of the loss function that TD minimises, as recently described by [Ollivier, 2018]. We show that the upper bounds from [Tsitsiklis and Van Roy, 1997] hold, but they do not imply that leakage propagation occurs and under what conditions. Finally, we test whether the problem could be mitigated with a better state representation, and whether it can be learned in an unsupervised manner, without rewards or privileged information.


Gradient Descent Quantizes ReLU Network Features

arXiv.org Machine Learning

Deep neural networks are often trained in the over-parametrized regime (i.e. with far more parameters than training examples), and understanding why the training converges to solutions that generalize remains an open problem. Several studies have highlighted the fact that the training procedure, i.e. mini-batch Stochastic Gradient Descent (SGD) leads to solutions that have specific properties in the loss landscape. However, even with plain Gradient Descent (GD) the solutions found in the over-parametrized regime are pretty good and this phenomenon is poorly understood. We propose an analysis of this behavior for feedforward networks with a ReLU activation function under the assumption of small initialization and learning rate and uncover a quantization effect: The weight vectors tend to concentrate at a small number of directions determined by the input data. As a consequence, we show that for given input data there are only finitely many, "simple" functions that can be obtained, independent of the network size. This puts these functions in analogy to linear interpolations (for given input data there are finitely many triangulations, which each determine a function by linear interpolation). We ask whether this analogy extends to the generalization properties - while the usual distribution-independent generalization property does not hold, it could be that for e.g. smooth functions with bounded second derivative an approximation property holds which could "explain" generalization of networks (of unbounded size) to unseen inputs.