Statistical Learning
Is One Epoch All You Need For Multi-Fidelity Hyperparameter Optimization?
Egele, Romain, Guyon, Isabelle, Sun, Yixuan, Balaprakash, Prasanna
Hyperparameter optimization (HPO) is crucial for fine-tuning machine learning models, but it can be computationally expensive. To reduce costs, Multi-fidelity HPO (MF-HPO) leverages intermediate accuracy levels in the learning process and discards low-performing models early on. We conducted a comparison of various representative MF-HPO methods against a simple baseline on classical benchmark data. The baseline involved discarding all models except the Top-K after training for only one epoch, followed by further training to select the best model. Surprisingly, this baseline achieved similar results to its counterparts, while requiring an order of magnitude less computation. Upon analyzing the learning curves of the benchmark data, we observed a few dominant learning curves, which explained the success of our baseline. This suggests that researchers should (1) always use the suggested baseline in benchmarks and (2) broaden the diversity of MF-HPO benchmarks to include more complex cases.
Data Distillation: A Survey
Sachdeva, Noveen, McAuley, Julian
The popularity of deep learning has led to the curation of a vast number of massive and multifarious datasets. Despite having close-to-human performance on individual tasks, training parameter-hungry models on large datasets poses multi-faceted problems such as (a) high model-training time; (b) slow research iteration; and (c) poor eco-sustainability. As an alternative, data distillation approaches aim to synthesize terse data summaries, which can serve as effective drop-in replacements of the original dataset for scenarios like model training, inference, architecture search, etc. In this survey, we present a formal framework for data distillation, along with providing a detailed taxonomy of existing approaches. Additionally, we cover data distillation approaches for different data modalities, namely images, graphs, and user-item interactions (recommender systems), while also identifying current challenges and future research directions.
Optimization with Access to Auxiliary Information
Chayti, El Mahdi, Karimireddy, Sai Praneeth
We investigate the fundamental optimization question of minimizing a target function $f$, whose gradients are expensive to compute or have limited availability, given access to some auxiliary side function $h$ whose gradients are cheap or more available. This formulation captures many settings of practical relevance, such as i) re-using batches in SGD, ii) transfer learning, iii) federated learning, iv) training with compressed models/dropout, etc. We propose two generic new algorithms that apply in all these settings and prove that we can benefit from this framework using only an assumption on the Hessian similarity between the target and side information. A benefit is obtained when this similarity measure is small, we also show a potential benefit from stochasticity when the auxiliary noise is correlated with that of the target function.
Targeting Relative Risk Heterogeneity with Causal Forests
Shirvaikar, Vik, Holmes, Chris
Treatment effect heterogeneity (TEH), or variability in treatment effect for different subgroups within a population, is of significant interest in clinical trial analysis. Causal forests (Wager and Athey, 2018) is a highly popular method for this problem, but like many other methods for detecting TEH, its criterion for separating subgroups focuses on differences in absolute risk. This can dilute statistical power by masking nuance in the relative risk, which is often a more appropriate quantity of clinical interest. In this work, we propose and implement a methodology for modifying causal forests to target relative risk using a novel node-splitting procedure based on generalized linear model (GLM) comparison. We present results on simulated and real-world data that suggest relative risk causal forests can capture otherwise unobserved sources of heterogeneity.
SOFARI: High-Dimensional Manifold-Based Inference
Zheng, Zemin, Zhou, Xin, Fan, Yingying, Lv, Jinchi
Multi-task learning is a widely used technique for harnessing information from various tasks. Recently, the sparse orthogonal factor regression (SOFAR) framework, based on the sparse singular value decomposition (SVD) within the coefficient matrix, was introduced for interpretable multi-task learning, enabling the discovery of meaningful latent feature-response association networks across different layers. However, conducting precise inference on the latent factor matrices has remained challenging due to orthogonality constraints inherited from the sparse SVD constraint. In this paper, we suggest a novel approach called high-dimensional manifold-based SOFAR inference (SOFARI), drawing on the Neyman near-orthogonality inference while incorporating the Stiefel manifold structure imposed by the SVD constraints. By leveraging the underlying Stiefel manifold structure, SOFARI provides bias-corrected estimators for both latent left factor vectors and singular values, for which we show to enjoy the asymptotic mean-zero normal distributions with estimable variances. We introduce two SOFARI variants to handle strongly and weakly orthogonal latent factors, where the latter covers a broader range of applications. We illustrate the effectiveness of SOFARI and justify our theoretical results through simulation examples and a real data application in economic forecasting.
Error Reduction from Stacked Regressions
Chen, Xin, Klusowski, Jason M., Tan, Yan Shuo
Stacking regressions is an ensemble technique that forms linear combinations of different regression estimators to enhance predictive accuracy. The conventional approach uses cross-validation data to generate predictions from the constituent estimators, and least-squares with nonnegativity constraints to learn the combination weights. In this paper, we learn these weights analogously by minimizing an estimate of the population risk subject to a nonnegativity constraint. When the constituent estimators are linear least-squares projections onto nested subspaces separated by at least three dimensions, we show that thanks to a shrinkage effect, the resulting stacked estimator has strictly smaller population risk than best single estimator among them. Here "best" refers to an estimator that minimizes a model selection criterion such as AIC or BIC. In other words, in this setting, the best single estimator is inadmissible. Because the optimization problem can be reformulated as isotonic regression, the stacked estimator requires the same order of computation as the best single estimator, making it an attractive alternative in terms of both performance and implementation.
Simultaneous inference for generalized linear models with unmeasured confounders
Du, Jin-Hong, Wasserman, Larry, Roeder, Kathryn
Tens of thousands of simultaneous hypothesis tests are routinely performed in genomic studies to identify differentially expressed genes. However, due to unmeasured confounders, many standard statistical approaches may be substantially biased. This paper investigates the large-scale hypothesis testing problem for multivariate generalized linear models in the presence of confounding effects. Under arbitrary confounding mechanisms, we propose a unified statistical estimation and inference framework that harnesses orthogonal structures and integrates linear projections into three key stages. It begins by disentangling marginal and uncorrelated confounding effects to recover the latent coefficients. Subsequently, latent factors and primary effects are jointly estimated through lasso-type optimization. Finally, we incorporate projected and weighted bias-correction steps for hypothesis testing. Theoretically, we establish the identification conditions of various effects and non-asymptotic error bounds. We show effective Type-I error control of asymptotic $z$-tests as sample and response sizes approach infinity. Numerical experiments demonstrate that the proposed method controls the false discovery rate by the Benjamini-Hochberg procedure and is more powerful than alternative methods. By comparing single-cell RNA-seq counts from two groups of samples, we demonstrate the suitability of adjusting confounding effects when significant covariates are absent from the model.
Distributionally Robust Machine Learning with Multi-source Data
Wang, Zhenyu, Bühlmann, Peter, Guo, Zijian
Classical machine learning methods may lead to poor prediction performance when the target distribution differs from the source populations. This paper utilizes data from multiple sources and introduces a group distributionally robust prediction model defined to optimize an adversarial reward about explained variance with respect to a class of target distributions. Compared to classical empirical risk minimization, the proposed robust prediction model improves the prediction accuracy for target populations with distribution shifts. We show that our group distributionally robust prediction model is a weighted average of the source populations' conditional outcome models. We leverage this key identification result to robustify arbitrary machine learning algorithms, including, for example, random forests and neural networks. We devise a novel bias-corrected estimator to estimate the optimal aggregation weight for general machine-learning algorithms and demonstrate its improvement in the convergence rate. Our proposal can be seen as a distributionally robust federated learning approach that is computationally efficient and easy to implement using arbitrary machine learning base algorithms, satisfies some privacy constraints, and has a nice interpretation of different sources' importance for predicting a given target covariate distribution. We demonstrate the performance of our proposed group distributionally robust method on simulated and real data with random forests and neural networks as base-learning algorithms.
Finite-time analysis of single-timescale actor-critic
Actor-critic methods have achieved significant success in many challenging applications. However, its finite-time convergence is still poorly understood in the most practical single-timescale form. Existing works on analyzing single-timescale actor-critic have been limited to i.i.d. sampling or tabular setting for simplicity. We investigate the more practical online single-timescale actor-critic algorithm on continuous state space, where the critic assumes linear function approximation and updates with a single Markovian sample per actor step. Previous analysis has been unable to establish the convergence for such a challenging scenario. We demonstrate that the online single-timescale actor-critic method provably finds an $\epsilon$-approximate stationary point with $\widetilde{\mathcal{O}}(\epsilon^{-2})$ sample complexity under standard assumptions, which can be further improved to $\mathcal{O}(\epsilon^{-2})$ under the i.i.d. sampling. Our novel framework systematically evaluates and controls the error propagation between the actor and critic. It offers a promising approach for analyzing other single-timescale reinforcement learning algorithms as well.
GeONet: a neural operator for learning the Wasserstein geodesic
Optimal transport (OT) offers a versatile framework to compare complex data distributions in a geometrically meaningful way. Traditional methods for computing the Wasserstein distance and geodesic between probability measures require mesh-dependent domain discretization and suffer from the curse-of-dimensionality. We present GeONet, a mesh-invariant deep neural operator network that learns the non-linear mapping from the input pair of initial and terminal distributions to the Wasserstein geodesic connecting the two endpoint distributions. In the offline training stage, GeONet learns the saddle point optimality conditions for the dynamic formulation of the OT problem in the primal and dual spaces that are characterized by a coupled PDE system. The subsequent inference stage is instantaneous and can be deployed for real-time predictions in the online learning setting. We demonstrate that GeONet achieves comparable testing accuracy to the standard OT solvers on simulation examples and the MNIST dataset with considerably reduced inference-stage computational cost by orders of magnitude. Recent years have seen tremendous progress in statistical and computational optimal transport (OT) as a lens to explore machine learning problems. One prominent example is to use the Wasserstein distance to compare data distributions in a geometrically meaningful way, which has found various applications, such as in generative models (Arjovsky et al., 2017), domain adaptation (Courty et al., 2017) and computational geometry (Solomon et al., 2015). Computing the optimal coupling and the optimal transport map (if it exists) can be expressed in a fluid dynamics formulation with the minimum kinetic energy (Benamou and Brenier, 2000).