A longstanding goal in deep learning research has been to precisely characterize training and generalization. However, the often complex loss landscapes of neural networks have made a theory of learning dynamics elusive. In this work, we show that for wide neural networks the learning dynamics simplify considerably and that, in the infinite width limit, they are governed by a linear model obtained from the first-order Taylor expansion of the network around its initial parameters. Furthermore, mirroring the correspondence between wide Bayesian neural networks and Gaussian processes, gradient-based training of wide neural networks with a squared loss produces test set predictions drawn from a Gaussian process with a particular compositional kernel. While these theoretical results are only exact in the infinite width limit, we nevertheless find excellent empirical agreement between the predictions of the original network and those of the linearized version even for finite practically-sized networks. This agreement is robust across different architectures, optimization methods, and loss functions.

Wide Neural Networks of Any Depth Evolve as Linear Models Under Gradient Descent

We identify and formalize a fundamental gradient descent phenomenon resulting in a learning proclivity in over-parameterized neural networks. Gradient Starvation arises when cross-entropy loss is minimized by capturing only a subset of features relevant for the task, despite the presence of other predictive features that fail to be discovered. This work provides a theoretical explanation for the emergence of such feature imbalance in neural networks. Using tools from Dynamical Systems theory, we identify simple properties of learning dynamics during gradient descent that lead to this imbalance, and prove that such a situation can be expected given certain statistical structure in training data. Based on our proposed formalism, we develop guarantees for a novel regularization method aimed at decoupling feature learning dynamics, improving accuracy and robustness in cases hindered by gradient starvation. We illustrate our findings with simple and real-world out-of-distribution (OOD) generalization experiments.

Gradient Starvation: A Learning Proclivity in Neural Networks

This paper explores the generalization loss of linear regression in variably parameterized families of models, both under-parameterized and over-parameterized. We show that the generalization curve can have an arbitrary number of peaks, and moreover, locations of those peaks can be explicitly controlled. Our results highlight the fact that both classical U-shaped generalization curve and the recently observed double descent curve are not intrinsic properties of the model family. Instead, their emergence is due to the interaction between the properties of the data and the inductive biases of learning algorithms.

pdf/multiple-descent-design-your-own-generalization-curve-1w31be34oo.pdf

Multiple Descent: Design Your Own Generalization Curve

Recent studies have shown that episodic reinforcement learning (RL) is not more difficult than contextual bandits, even with a long planning horizon and unknown state transitions. However, these results are limited to either tabular Markov decision processes (MDPs) or computationally inefficient algorithms for linear mixture MDPs. In this paper, we propose the first computationally efficient horizon-free algorithm for linear mixture MDPs, which achieves the optimal $\tilde O(d\sqrt{K} +d^2)$ regret up to logarithmic factors. Our algorithm adapts a weighted least square estimator for the unknown transitional dynamic, where the weight is both \emph{variance-aware} and \emph{uncertainty-aware}. When applying our weighted least square estimator to heterogeneous linear bandits, we can obtain an $\tilde O(d\sqrt{\sum_{k=1}^K \sigma_k^2} +d)$ regret in the first $K$ rounds, where $d$ is the dimension of the context and $\sigma_k^2$ is the variance of the reward in the $k$-th round. This also improves upon the best-known algorithms in this setting when $\sigma_k^2$'s are known.

pdf/computationally-efficient-horizon-free-reinforcement-3ulycwkt.pdf

Computationally Efficient Horizon-Free Reinforcement Learning for Linear Mixture MDPs

Deep neural networks have successfully been trained in various application areas with stochastic gradient descent. However, there exists no rigorous mathematical explanation why this works so well. The training of neural networks with stochastic gradient descent has four different discretization parameters: (i) the network architecture; (ii) the size of the training data; (iii) the number of gradient steps; and (iv) the number of randomly initialized gradient trajectories. While it can be shown that the approximation error converges to zero if all four parameters are sent to infinity in the right order, we demonstrate in this paper that stochastic gradient descent fails to converge for rectified linear unit networks if their depth is much larger than their width and the number of random initializations does not increase to infinity fast enough.

Non-convergence of stochastic gradient descent in the training of deep neural networks

We study the linear contextual bandit problem in the presence of adversarial corruption, where the reward at each round is corrupted by an adversary, and the corruption level (i.e., the sum of corruption magnitudes over the horizon) is $C\geq 0$. The best-known algorithms in this setting are limited in that they either are computationally inefficient or require a strong assumption on the corruption, or their regret is at least $C$ times worse than the regret without corruption. In this paper, to overcome these limitations, we propose a new algorithm based on the principle of optimism in the face of uncertainty. At the core of our algorithm is a weighted ridge regression where the weight of each chosen action depends on its confidence up to some threshold. We show that for both known $C$ and unknown $C$ cases, our algorithm with proper choice of hyperparameter achieves a regret that nearly matches the lower bounds. Thus, our algorithm is nearly optimal up to logarithmic factors for both cases. Notably, our algorithm achieves the near-optimal regret for both corrupted and uncorrupted cases ($C=0$) simultaneously.

Nearly Optimal Algorithms for Linear Contextual Bandits with Adversarial Corruptions

Recently, several studies (Zhou et al., 2021a; Zhang et al., 2021b; Kim et al., 2021; Zhou and Gu, 2022) have provided variance-dependent regret bounds for linear contextual bandits, which interpolates the regret for the worst-case regime and the deterministic reward regime. However, these algorithms are either computationally intractable or unable to handle unknown variance of the noise. In this paper, we present a novel solution to this open problem by proposing the first computationally efficient algorithm for linear bandits with heteroscedastic noise. Our algorithm is adaptive to the unknown variance of noise and achieves an $\tilde{O}(d \sqrt{\sum_{k = 1}^K \sigma_k^2} + d)$ regret, where $\sigma_k^2$ is the variance of the noise at the round $k$, $d$ is the dimension of the contexts and $K$ is the total number of rounds. Our results are based on an adaptive variance-aware confidence set enabled by a new Freedman-type concentration inequality for self-normalized martingales and a multi-layer structure to stratify the context vectors into different layers with different uniform upper bounds on the uncertainty. Furthermore, our approach can be extended to linear mixture Markov decision processes (MDPs) in reinforcement learning. We propose a variance-adaptive algorithm for linear mixture MDPs, which achieves a problem-dependent horizon-free regret bound that can gracefully reduce to a nearly constant regret for deterministic MDPs. Unlike existing nearly minimax optimal algorithms for linear mixture MDPs, our algorithm does not require explicit variance estimation of the transitional probabilities or the use of high-order moment estimators to attain horizon-free regret. We believe the techniques developed in this paper can have independent value for general online decision making problems.

pdf/variance-dependent-regret-bounds-for-linear-bandits-and-28zvdvdp.pdf

Variance-Dependent Regret Bounds for Linear Bandits and Reinforcement Learning: Adaptivity and Computational Efficiency

Thanks to the power of representation learning, neural contextual bandit algorithms demonstrate remarkable performance improvement against their classical counterparts. But because their exploration has to be performed in the entire neural network parameter space to obtain nearly optimal regret, the resulting computational cost is prohibitively high. We perturb the rewards when updating the neural network to eliminate the need of explicit exploration and the corresponding computational overhead. We prove that a Õ(d̃ √ T ) regret upper bound is still achievable under standard regularity conditions, where T is the number of rounds of interactions and d̃ is the effective dimension of a neural tangent kernel matrix. Extensive comparisons with several benchmark contextual bandit algorithms, including two recent neural contextual bandit models, demonstrate the effectiveness and computational efficiency of our proposed neural bandit algorithm.

Learning Neural Contextual Bandits through Perturbed Rewards

We consider learning a stochastic bandit model, where the reward function belongs to a general class of uniformly bounded functions, and the additive noise can be heteroscedastic. Our model captures contextual linear bandits and generalized linear bandits as special cases. While previous works (Kirschner and Krause, 2018; Zhou et al., 2021) based on weighted ridge regression can deal with linear bandits with heteroscedastic noise, they are not directly applicable to our general model due to the curse of nonlinearity. In order to tackle this problem, we propose a multi-level learning framework for the general bandit model. The core idea of our framework is to partition the observed data into diﬀerent levels according to the variance of their respective reward and perform online learning at each level collaboratively. Under our framework, we ﬁrst design an algorithm that constructs the variance-aware conﬁdence set based on empirical risk minimization and prove a variance-dependent regret bound. For generalized linear bandits, we further propose an algorithm based on follow-the-regularized-leader (FTRL) subroutine and online-to-conﬁdence-set conversion, which can achieve a tighter variance-dependent regret under certain conditions.

Bandit Learning with General Function Classes: Heteroscedastic Noise and Variance-dependent Regret Bounds

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