skip to main content


Title: Reconciling modern machine-learning practice and the classical bias–variance trade-off
Breakthroughs in machine learning are rapidly changing science and society, yet our fundamental understanding of this technology has lagged far behind. Indeed, one of the central tenets of the field, the bias–variance trade-off, appears to be at odds with the observed behavior of methods used in modern machine-learning practice. The bias–variance trade-off implies that a model should balance underfitting and overfitting: Rich enough to express underlying structure in data and simple enough to avoid fitting spurious patterns. However, in modern practice, very rich models such as neural networks are trained to exactly fit (i.e., interpolate) the data. Classically, such models would be considered overfitted, and yet they often obtain high accuracy on test data. This apparent contradiction has raised questions about the mathematical foundations of machine learning and their relevance to practitioners. In this paper, we reconcile the classical understanding and the modern practice within a unified performance curve. This “double-descent” curve subsumes the textbook U-shaped bias–variance trade-off curve by showing how increasing model capacity beyond the point of interpolation results in improved performance. We provide evidence for the existence and ubiquity of double descent for a wide spectrum of models and datasets, and we posit a mechanism for its emergence. This connection between the performance and the structure of machine-learning models delineates the limits of classical analyses and has implications for both the theory and the practice of machine learning.  more » « less
Award ID(s):
1740833 1815697
PAR ID:
10112805
Author(s) / Creator(s):
; ; ;
Date Published:
Journal Name:
Proceedings of the National Academy of Sciences
Volume:
116
Issue:
32
ISSN:
0027-8424
Page Range / eLocation ID:
15849 to 15854
Format(s):
Medium: X
Sponsoring Org:
National Science Foundation
More Like this
  1. null (Ed.)
    Over-parameterized models, such as large deep networks, often exhibit a double descent phenomenon, whereas a function of model size, error first decreases, increases, and decreases at last. This intriguing double descent behavior also occurs as a function of training epochs and has been conjectured to arise because training epochs control the model complexity. In this paper, we show that such epoch-wise double descent arises for a different reason: It is caused by a superposition of two or more bias-variance tradeoffs that arise because different parts of the network are learned at different epochs, and eliminating this by proper scaling of stepsizes can significantly improve the early stopping performance. We show this analytically for i) linear regression, where differently scaled features give rise to a superposition of bias-variance tradeoffs, and for ii) a two-layer neural network, where the first and second layer each govern a bias-variance tradeoff. Inspired by this theory, we study two standard convolutional networks empirically and show that eliminating epoch-wise double descent through adjusting stepsizes of different layers improves the early stopping performance significantly. 
    more » « less
  2. The risk of overparameterized models, in particular deep neural networks, is often double- descent shaped as a function of the model size. Recently, it was shown that the risk as a function of the early-stopping time can also be double-descent shaped, and this behavior can be explained as a super-position of bias-variance tradeoffs. In this paper, we show that the risk of explicit L2-regularized models can exhibit double descent behavior as a function of the regularization strength, both in theory and practice. We find that for linear regression, a double descent shaped risk is caused by a superposition of bias-variance tradeoffs corresponding to different parts of the model and can be mitigated by scaling the regularization strength of each part appropriately. Motivated by this result, we study a two-layer neural network and show that double descent can be eliminated by adjusting the regularization strengths for the first and second layer. Lastly, we study a 5-layer CNN and ResNet-18 trained on CIFAR-10 with label noise, and CIFAR-100 without label noise, and demonstrate that all exhibit double descent behavior as a function of the regularization strength. 
    more » « less
  3. Avoiding overfitting is a central challenge in machine learning, yet many large neural networks readily achieve zero training loss. This puzzling contradiction necessitates new approaches to the study of overfitting. Here we quantify overfitting via residual information, defined as the bits in fitted models that encode noise in training data. Information efficient learning algorithms minimize residual information while maximizing the relevant bits, which are predictive of the unknown generative models. We solve this optimization to obtain the information content of optimal algorithms for a linear regression problem and compare it to that of randomized ridge regression. Our results demonstrate the fundamental trade-off between residual and relevant information and characterize the relative information efficiency of randomized regression with respect to optimal algorithms. Finally, using results from random matrix theory, we reveal the information complexity of learning a linear map in high dimensions and unveil information-theoretic analogs of double and multiple descent phenomena. 
    more » « less
  4. Dealing with high variance is a significant challenge in model-free reinforcement learning (RL). Existing methods are unreliable, exhibiting high variance in performance from run to run using different initializations/seeds. Focusing on problems arising in continuous control, we propose a functional regularization approach to augmenting model-free RL. In particular, we regularize the behavior of the deep policy to be similar to a control prior, i.e., we regularize in function space. We show that functional regularization yields a bias-variance trade-off, and propose an adaptive tuning strategy to optimize this trade-off. When the prior policy has control-theoretic stability guarantees, we further show that this regularization approximately preserves those stability guarantees throughout learning. We validate our approach empirically on a wide range of settings, and demonstrate significantly reduced variance, guaranteed dynamic stability, and more efficient learning than deep RL alone. 
    more » « less
  5. We propose and study a data-driven method that can interpolate between a classical and a modern approach to classification for a class of linear models. The class is the convex combinations of an average of the source task classifiers and a classifier trained on the limited data available for the target task. We derive the expected loss of an element in the class with respect to the target distribution for a specific generative model, propose a computable approximation of the loss, and demonstrate that the element of the proposed class that minimizes the approximated risk is able to exploit a natural bias–variance trade-off in task space in both simulated and real-data settings. We conclude by discussing further applications, limitations, and potential future research directions.

     
    more » « less