13 accepted papers
Transformers have achieved remarkable success across a wide range of applications, a feat often attributed to their scalability. Yet training them without residual (skip) connections remains notoriously difficult. While skips stabilize optimization, they also disrupt the hierarchical structure of re…
Normalization layers have recently experienced a renaissance in the deep reinforcement learning and continual learning literature, with several works highlighting diverse benefits such as improving loss landscape conditioning and combatting overestimation bias. However, normalization brings with it…
Skip connections and normalisation layers form two standard architectural components that are ubiquitous for the training of Deep Neural Networks (DNNs), but whose precise roles are poorly understood. Recent approaches such as Deep Kernel Shaping have made progress towards reducing our reliance on t…
Many important problems involving molecular property prediction from 3D structures have limited data, posing a generalization challenge for neural networks. In this paper, we describe a pre-training technique based on denoising that achieves a new state-of-the-art in molecular property prediction by…
Training very deep neural networks is still an extremely challenging task. The common solution is to use shortcut connections and normalization layers, which are both crucial ingredients in the popular ResNet architecture. However, there is strong evidence to suggest that ResNets behave more like en…
Adversarial training is an effective methodology for training deep neural networks that are robust against adversarial, norm-bounded perturbations. However, the computational cost of adversarial training grows prohibitively as the size of the model and number of input dimensions increase. Further, t…
Natural gradient descent has proven very effective at mitigating the catastrophic effects of pathological curvature in the objective function, but little is known theoretically about its convergence properties, especially for \emph{non-linear} networks. In this work, we analyze for the first time th…
Increasing the batch size is a popular way to speed up neural network training, but beyond some critical batch size, larger batch sizes yield diminishing returns. In this work, we study how the critical batch size changes based on properties of the optimization algorithm, including acceleration and…
Kronecker-factor Approximate Curvature (Martens & Grosse, 2015) (K-FAC) is a 2nd-order optimization method which has been shown to give state-of-the-art performance on large-scale neural network optimization tasks (Ba et al., 2017). It is based on an approximation to the Fisher information matrix (…
The cornerstone underpinning deep learning is the guarantee that gradient descent on an objective converges to local minima. Unfortunately, this guarantee fails in settings, such as generative adversarial nets, where there are multiple interacting losses. The behavior of gradient-based methods in ga…
As more computational resources become available, machine learning researchers train ever larger neural networks on millions of data points using stochastic gradient descent (SGD). Although SGD scales well in terms of both the size of dataset and the number of parameters of the model, it has rapidly…
Second-order optimization methods such as natural gradient descent have the potential to speed up training of neural networks by correcting for the curvature of the loss function. Unfortunately, the exact natural gradient is impractical to compute for large models, and most approximations either req…
We propose an efficient method for approximating natural gradient descent in neural networks which we call Kronecker-factored Approximate Curvature (K-FAC). K-FAC is based on an efficiently invertible approximation of a neural network’s Fisher information matrix which is neither diagonal nor low-ran…