Statistical Learning
Stage-Aware Learning for Dynamic Treatments
Ye, Hanwen, Zhou, Wenzhuo, Zhu, Ruoqing, Qu, Annie
Recent advances in dynamic treatment regimes (DTRs) provide powerful optimal treatment searching algorithms, which are tailored to individuals' specific needs and able to maximize their expected clinical benefits. However, existing algorithms could suffer from insufficient sample size under optimal treatments, especially for chronic diseases involving long stages of decision-making. To address these challenges, we propose a novel individualized learning method which estimates the DTR with a focus on prioritizing alignment between the observed treatment trajectory and the one obtained by the optimal regime across decision stages. By relaxing the restriction that the observed trajectory must be fully aligned with the optimal treatments, our approach substantially improves the sample efficiency and stability of inverse probability weighted based methods. In particular, the proposed learning scheme builds a more general framework which includes the popular outcome weighted learning framework as a special case of ours. Moreover, we introduce the notion of stage importance scores along with an attention mechanism to explicitly account for heterogeneity among decision stages. We establish the theoretical properties of the proposed approach, including the Fisher consistency and finite-sample performance bound. Empirically, we evaluate the proposed method in extensive simulated environments and a real case study for COVID-19 pandemic.
The Memory Perturbation Equation: Understanding Model's Sensitivity to Data
Nickl, Peter, Xu, Lu, Tailor, Dharmesh, Möllenhoff, Thomas, Khan, Mohammad Emtiyaz
Understanding model's sensitivity to its training data is crucial but can also be challenging and costly, especially during training. To simplify such issues, we present the Memory-Perturbation Equation (MPE) which relates model's sensitivity to perturbation in its training data. Derived using Bayesian principles, the MPE unifies existing sensitivity measures, generalizes them to a wide-variety of models and algorithms, and unravels useful properties regarding sensitivities. Our empirical results show that sensitivity estimates obtained during training can be used to faithfully predict generalization on unseen test data. The proposed equation is expected to be useful for future research on robust and adaptive learning.
Sharpness-Aware Minimization and the Edge of Stability
Long, Philip M., Bartlett, Peter L.
Sharpness-aware Minimization (SAM) [Foret et al., 2020] is a new gradient-based neural network training algorithm that advanced the state-of-the-art test accuracy on a number of prominent benchmark datasets. As its name suggests, it explicitly seeks to find a solution that not only fits the training data, but that avoids "sharp" minima, for which nearby parameter vectors perform poorly. SAM is an incremental algorithm that updates its parameters using a gradient computed at a neighbor of the current solution. The neighbor is the point in parameter space found by taking a step of length ρ "uphill" in the gradient direction. The practical success of SAM has motivated theoretical research [Bartlett et al., 2022, Wen et al., 2023, Andriushchenko et al., 2023], including results highlighting senses in which SAM's update may be viewed, under certain conditions, as including a component that performs gradient descent on the operator norm of the Hessian [Bartlett et al., 2022, Wen et al., 2023]. Meanwhile, Cohen et al. [2021], building on the work of Jastrzebski et al. [2020] and others, exposed a striking phenomenon regarding neural network training with the original gradient descent (GD) method: for many initialization schemes and learning rates η, the operator norm of the Hessian eventually settles in the neighborhood of 2/η. This has been termed the "edge of stability", in part because a convex quadratic trained by gradient descent with a learning rate η will only Also affiliated with University of California, Berkeley.
Pareto Frontiers in Neural Feature Learning: Data, Compute, Width, and Luck
Edelman, Benjamin L., Goel, Surbhi, Kakade, Sham, Malach, Eran, Zhang, Cyril
In modern deep learning, algorithmic choices (such as width, depth, and learning rate) are known to modulate nuanced resource tradeoffs. This work investigates how these complexities necessarily arise for feature learning in the presence of computational-statistical gaps. We begin by considering offline sparse parity learning, a supervised classification problem which admits a statistical query lower bound for gradient-based training of a multilayer perceptron. This lower bound can be interpreted as a multi-resource tradeoff frontier: successful learning can only occur if one is sufficiently rich (large model), knowledgeable (large dataset), patient (many training iterations), or lucky (many random guesses). We show, theoretically and experimentally, that sparse initialization and increasing network width yield significant improvements in sample efficiency in this setting. Here, width plays the role of parallel search: it amplifies the probability of finding "lottery ticket" neurons, which learn sparse features more sample-efficiently. Finally, we show that the synthetic sparse parity task can be useful as a proxy for real problems requiring axis-aligned feature learning. We demonstrate improved sample efficiency on tabular classification benchmarks by using wide, sparsely-initialized MLP models; these networks sometimes outperform tuned random forests.
SGMM: Stochastic Approximation to Generalized Method of Moments
Chen, Xiaohong, Lee, Sokbae, Liao, Yuan, Seo, Myung Hwan, Shin, Youngki, Song, Myunghyun
We introduce a new class of algorithms, Stochastic Generalized Method of Moments (SGMM), for estimation and inference on (overidentified) moment restriction models. Our SGMM is a novel stochastic approximation alternative to the popular Hansen (1982) (offline) GMM, and offers fast and scalable implementation with the ability to handle streaming datasets in real time. We establish the almost sure convergence, and the (functional) central limit theorem for the inefficient online 2SLS and the efficient SGMM. Moreover, we propose online versions of the Durbin-Wu-Hausman and Sargan-Hansen tests that can be seamlessly integrated within the SGMM framework. Extensive Monte Carlo simulations show that as the sample size increases, the SGMM matches the standard (offline) GMM in terms of estimation accuracy and gains over computational efficiency, indicating its practical value for both large-scale and online datasets. We demonstrate the efficacy of our approach by a proof of concept using two well known empirical examples with large sample sizes.
Fast Optimal Transport through Sliced Wasserstein Generalized Geodesics
Mahey, Guillaume, Chapel, Laetitia, Gasso, Gilles, Bonet, Clément, Courty, Nicolas
Wasserstein distance (WD) and the associated optimal transport plan have been proven useful in many applications where probability measures are at stake. In this paper, we propose a new proxy of the squared WD, coined min-SWGG, that is based on the transport map induced by an optimal one-dimensional projection of the two input distributions. We draw connections between min-SWGG and Wasserstein generalized geodesics in which the pivot measure is supported on a line. We notably provide a new closed form for the exact Wasserstein distance in the particular case of one of the distributions supported on a line allowing us to derive a fast computational scheme that is amenable to gradient descent optimization. We show that min-SWGG is an upper bound of WD and that it has a complexity similar to as Sliced-Wasserstein, with the additional feature of providing an associated transport plan. We also investigate some theoretical properties such as metricity, weak convergence, computational and topological properties. Empirical evidences support the benefits of min-SWGG in various contexts, from gradient flows, shape matching and image colorization, among others.
On the Robustness of Removal-Based Feature Attributions
Lin, Chris, Covert, Ian, Lee, Su-In
To explain predictions made by complex machine learning models, many feature attribution methods have been developed that assign importance scores to input features. Some recent work challenges the robustness of these methods by showing that they are sensitive to input and model perturbations, while other work addresses this issue by proposing robust attribution methods. However, previous work on attribution robustness has focused primarily on gradient-based feature attributions, whereas the robustness of removal-based attribution methods is not currently well understood. To bridge this gap, we theoretically characterize the robustness properties of removal-based feature attributions. Specifically, we provide a unified analysis of such methods and derive upper bounds for the difference between intact and perturbed attributions, under settings of both input and model perturbations. Our empirical results on synthetic and real-world data validate our theoretical results and demonstrate their practical implications, including the ability to increase attribution robustness by improving the model's Lipschitz regularity.
Intensity Profile Projection: A Framework for Continuous-Time Representation Learning for Dynamic Networks
Modell, Alexander, Gallagher, Ian, Ceccherini, Emma, Whiteley, Nick, Rubin-Delanchy, Patrick
We present a new representation learning framework, Intensity Profile Projection, for continuous-time dynamic network data. Given triples $(i,j,t)$, each representing a time-stamped ($t$) interaction between two entities ($i,j$), our procedure returns a continuous-time trajectory for each node, representing its behaviour over time. The framework consists of three stages: estimating pairwise intensity functions, e.g. via kernel smoothing; learning a projection which minimises a notion of intensity reconstruction error; and constructing evolving node representations via the learned projection. The trajectories satisfy two properties, known as structural and temporal coherence, which we see as fundamental for reliable inference. Moreoever, we develop estimation theory providing tight control on the error of any estimated trajectory, indicating that the representations could even be used in quite noise-sensitive follow-on analyses. The theory also elucidates the role of smoothing as a bias-variance trade-off, and shows how we can reduce the level of smoothing as the signal-to-noise ratio increases on account of the algorithm `borrowing strength' across the network.
Using Imperfect Surrogates for Downstream Inference: Design-based Supervised Learning for Social Science Applications of Large Language Models
Egami, Naoki, Hinck, Musashi, Stewart, Brandon M., Wei, Hanying
In computational social science (CSS), researchers analyze documents to explain social and political phenomena. In most scenarios, CSS researchers first obtain labels for documents and then explain labels using interpretable regression analyses in the second step. One increasingly common way to annotate documents cheaply at scale is through large language models (LLMs). However, like other scalable ways of producing annotations, such surrogate labels are often imperfect and biased. We present a new algorithm for using imperfect annotation surrogates for downstream statistical analyses while guaranteeing statistical properties -- like asymptotic unbiasedness and proper uncertainty quantification -- which are fundamental to CSS research. We show that direct use of surrogate labels in downstream statistical analyses leads to substantial bias and invalid confidence intervals, even with high surrogate accuracy of 80--90\%. To address this, we build on debiased machine learning to propose the design-based supervised learning (DSL) estimator. DSL employs a doubly-robust procedure to combine surrogate labels with a smaller number of high-quality, gold-standard labels. Our approach guarantees valid inference for downstream statistical analyses, even when surrogates are arbitrarily biased and without requiring stringent assumptions, by controlling the probability of sampling documents for gold-standard labeling. Both our theoretical analysis and experimental results show that DSL provides valid statistical inference while achieving root mean squared errors comparable to existing alternatives that focus only on prediction without inferential guarantees.
Learning under random distributional shifts
Bansak, Kirk, Paulson, Elisabeth, Rothenhäusler, Dominik
In various real-world settings, however, we might expect shifts to arise through the superposition of many small and random changes in the population and environment. Thus, we consider a class of random distribution shift models that capture arbitrary changes in the underlying covariate space, and dense, random shocks to the relationship between the covariates and the outcomes. In this setting, we characterize the benefits and drawbacks of several alternative prediction strategies: the standard approach that directly predicts the long-term outcomes of interest, the proxy approach that directly predicts a shorter-term proxy outcome, and a hybrid approach that utilizes both the long-term policy outcome and (shorter-term) proxy outcome(s). We show that the hybrid approach is robust to the strength of the distribution shift and the proxy relationship. We apply this method to datasets in two high-impact domains: asylum-seeker resettlement and early childhood education. In both settings, we find that the proposed approach results in substantially lower mean-squared error than current approaches.