minimizability gap
Fundamental Novel Consistency Theory: $H$-Consistency Bounds
In machine learning, the loss functions optimized during training often differ from the target loss that defines task performance due to computational intractability or lack of differentiability. We present an in-depth study of the target loss estimation error relative to the surrogate loss estimation error. Our analysis leads to $H$-consistency bounds, which are guarantees accounting for the hypothesis set $H$. These bounds offer stronger guarantees than Bayes-consistency or $H$-calibration and are more informative than excess error bounds. We begin with binary classification, establishing tight distribution-dependent and -independent bounds. We provide explicit bounds for convex surrogates (including linear models and neural networks) and analyze the adversarial setting for surrogates like $ρ$-margin and sigmoid loss. Extending to multi-class classification, we present the first $H$-consistency bounds for max, sum, and constrained losses, covering both non-adversarial and adversarial scenarios. We demonstrate that in some cases, non-trivial $H$-consistency bounds are unattainable. We also investigate comp-sum losses (e.g., cross-entropy, MAE), deriving their first $H$-consistency bounds and introducing smooth adversarial variants that yield robust learning algorithms. We develop a comprehensive framework for deriving these bounds across various surrogates, introducing new characterizations for constrained and comp-sum losses. Finally, we examine the growth rates of $H$-consistency bounds, establishing a universal square-root growth rate for smooth surrogates in binary and multi-class tasks, and analyze minimizability gaps to guide surrogate selection.
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Theory and Algorithms for Learning with Multi-Class Abstention and Multi-Expert Deferral
Large language models (LLMs) have achieved remarkable performance but face critical challenges: hallucinations and high inference costs. Leveraging multiple experts offers a solution: deferring uncertain inputs to more capable experts improves reliability, while routing simpler queries to smaller, distilled models enhances efficiency. This motivates the problem of learning with multiple-expert deferral. This thesis presents a comprehensive study of this problem and the related problem of learning with abstention, supported by strong consistency guarantees. First, for learning with abstention (a special case of deferral), we analyze score-based and predictor-rejector formulations in multi-class classification. We introduce new families of surrogate losses and prove strong non-asymptotic, hypothesis set-specific consistency guarantees, resolving two existing open questions. We analyze both single-stage and practical two-stage settings, with experiments on CIFAR-10, CIFAR-100, and SVHN demonstrating the superior performance of our algorithms. Second, we address general multi-expert deferral in classification. We design new surrogate losses for both single-stage and two-stage scenarios and prove they benefit from strong $H$-consistency bounds. For the two-stage scenario, we show that our surrogate losses are realizable $H$-consistent for constant cost functions, leading to effective new algorithms. Finally, we introduce a novel framework for regression with deferral to address continuous label spaces. Our versatile framework accommodates multiple experts and various cost structures, supporting both single-stage and two-stage methods. It subsumes recent work on regression with abstention. We propose new surrogate losses with proven $H$-consistency and demonstrate the empirical effectiveness of the resulting algorithms.
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A Universal Growth Rate for Learning with Smooth Surrogate Losses
Mao, Anqi, Mohri, Mehryar, Zhong, Yutao
This paper presents a comprehensive analysis of the growth rate of $H$-consistency bounds (and excess error bounds) for various surrogate losses used in classification. We prove a square-root growth rate near zero for smooth margin-based surrogate losses in binary classification, providing both upper and lower bounds under mild assumptions. This result also translates to excess error bounds. Our lower bound requires weaker conditions than those in previous work for excess error bounds, and our upper bound is entirely novel. Moreover, we extend this analysis to multi-class classification with a series of novel results, demonstrating a universal square-root growth rate for smooth comp-sum and constrained losses, covering common choices for training neural networks in multi-class classification. Given this universal rate, we turn to the question of choosing among different surrogate losses. We first examine how $H$-consistency bounds vary across surrogates based on the number of classes. Next, ignoring constants and focusing on behavior near zero, we identify minimizability gaps as the key differentiating factor in these bounds. Thus, we thoroughly analyze these gaps, to guide surrogate loss selection, covering: comparisons across different comp-sum losses, conditions where gaps become zero, and general conditions leading to small gaps. Additionally, we demonstrate the key role of minimizability gaps in comparing excess error bounds and $H$-consistency bounds.
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Cross-Entropy Loss Functions: Theoretical Analysis and Applications
Mao, Anqi, Mohri, Mehryar, Zhong, Yutao
Cross-entropy is a widely used loss function in applications. It coincides with the logistic loss applied to the outputs of a neural network, when the softmax is used. But, what guarantees can we rely on when using cross-entropy as a surrogate loss? We present a theoretical analysis of a broad family of loss functions, comp-sum losses, that includes cross-entropy (or logistic loss), generalized cross-entropy, the mean absolute error and other cross-entropy-like loss functions. We give the first $H$-consistency bounds for these loss functions. These are non-asymptotic guarantees that upper bound the zero-one loss estimation error in terms of the estimation error of a surrogate loss, for the specific hypothesis set $H$ used. We further show that our bounds are tight. These bounds depend on quantities called minimizability gaps. To make them more explicit, we give a specific analysis of these gaps for comp-sum losses. We also introduce a new family of loss functions, smooth adversarial comp-sum losses, that are derived from their comp-sum counterparts by adding in a related smooth term. We show that these loss functions are beneficial in the adversarial setting by proving that they admit $H$-consistency bounds. This leads to new adversarial robustness algorithms that consist of minimizing a regularized smooth adversarial comp-sum loss. While our main purpose is a theoretical analysis, we also present an extensive empirical analysis comparing comp-sum losses. We further report the results of a series of experiments demonstrating that our adversarial robustness algorithms outperform the current state-of-the-art, while also achieving a superior non-adversarial accuracy.
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