Statistical Learning
Scalable Simulation-Based Model Inference with Test-Time Complexity Control
Gloeckler, Manuel, Manzano-Patrón, J. P., Sotiropoulos, Stamatios N., Schröder, Cornelius, Macke, Jakob H.
Simulation plays a central role in scientific discovery. In many applications, the bottleneck is no longer running a simulator; it is choosing among large families of plausible simulators, each corresponding to different forward models/hypotheses consistent with observations. Over large model families, classical Bayesian workflows for model selection are impractical. Furthermore, amortized model selection methods typically hard-code a fixed model prior or complexity penalty at training time, requiring users to commit to a particular parsimony assumption before seeing the data. We introduce PRISM, a simulation-based encoder-decoder that infers a joint posterior over both discrete model structures and associated continuous parameters, while enabling test-time control of model complexity via a tunable model prior that the network is conditioned on. We show that PRISM scales to families with combinatorially many (up to billions) of model instantiations on a synthetic symbolic regression task. As a scientific application, we evaluate PRISM on biophysical modeling for diffusion MRI data, showing the ability to perform model selection across several multi-compartment models, on both synthetic and in vivo neuroimaging data.
EmDT: Embedding Diffusion Transformer for Tabular Data Generation in Fraud Detection
Imbalanced datasets pose a difficulty in fraud detection, as classifiers are often biased toward the majority class and perform poorly on rare fraudulent transactions. Synthetic data generation is therefore commonly used to mitigate this problem. In this work, we propose the Clustered Embedding Diffusion-Transformer (EmDT), a diffusion model designed to generate fraudulent samples. Our key innovation is to leverage UMAP clustering to identify distinct fraudulent patterns, and train a Transformer denoising network with sinusoidal positional embeddings to capture feature relationships throughout the diffusion process. Once the synthetic data has been generated, we employ a standard decision-tree-based classifier (e.g., XGBoost) for classification, as this type of model remains better suited to tabular datasets. Experiments on a credit card fraud detection dataset demonstrate that EmDT significantly improves downstream classification performance compared to existing oversampling and generative methods, while maintaining comparable privacy protection and preserving feature correlations present in the original data.
High-Probability Bounds for SGD under the Polyak-Lojasiewicz Condition with Markovian Noise
Kar, Avik, Chandak, Siddharth, Singh, Rahul, Moulines, Eric, Bhatnagar, Shalabh, Bambos, Nicholas
We present the first uniform-in-time high-probability bound for SGD under the PL condition, where the gradient noise contains both Markovian and martingale difference components. This significantly broadens the scope of finite-time guarantees, as the PL condition arises in many machine learning and deep learning models while Markovian noise naturally arises in decentralized optimization and online system identification problems. We further allow the magnitude of noise to grow with the function value, enabling the analysis of many practical sampling strategies. In addition to the high-probability guarantee, we establish a matching $1/k$ decay rate for the expected suboptimality. Our proof technique relies on the Poisson equation to handle the Markovian noise and a probabilistic induction argument to address the lack of almost-sure bounds on the objective. Finally, we demonstrate the applicability of our framework by analyzing three practical optimization problems: token-based decentralized linear regression, supervised learning with subsampling for privacy amplification, and online system identification.
When Should Humans Step In? Optimal Human Dispatching in AI-Assisted Decisions
Tan, Lezhi, Sagan, Naomi, Lei, Lihua, Blanchet, Jose
AI systems increasingly assist human decision making by producing preliminary assessments of complex inputs. However, such AI-generated assessments can often be noisy or systematically biased, raising a central question: how should costly human effort be allocated to correct AI outputs where it matters the most for the final decision? We propose a general decision-theoretic framework for human-AI collaboration in which AI assessments are treated as factor-level signals and human judgments as costly information that can be selectively acquired. We consider cases where the optimal selection problem reduces to maximizing a reward associated with each candidate subset of factors, and turn policy design into reward estimation. We develop estimation procedures under both nonparametric and linear models, covering contextual and non-contextual selection rules. In the linear setting, the optimal rule admits a closed-form expression with a clear interpretation in terms of factor importance and residual variance. We apply our framework to AI-assisted peer review. Our approach substantially outperforms LLM-only predictions and achieves performance comparable to full human review while using only 20-30% of the human information. Across different selection rules, we find that simpler rules derived under linear models can significantly reduce computational cost without harming final prediction performance. Our results highlight both the value of human intervention and the efficiency of principled dispatching.
Stochastic Expectation Maximization with Variance Reduction
Expectation-Maximization (EM) is a popular tool for learning latent variable models, but the vanilla batch EM does not scale to large data sets because the whole data set is needed at every E-step. Stochastic Expectation Maximization (sEM) reduces the cost of E-step by stochastic approximation. However, sEM has a slower asymptotic convergence rate than batch EM, and requires a decreasing sequence of step sizes, which is difficult to tune. In this paper, we propose a variance reduced stochastic EM (sEM-vr) algorithm inspired by variance reduced stochastic gradient descent algorithms. We show that sEM-vr has the same exponential asymptotic convergence rate as batch EM. Moreover, sEM-vr only requires a constant step size to achieve this rate, which alleviates the burden of parameter tuning. We compare sEM-vr with batch EM, sEM and other algorithms on Gaussian mixture models and probabilistic latent semantic analysis, and sEM-vr converges significantly faster than these baselines.
Doubly Robust Bayesian Inference for Non-Stationary Streaming Data with \beta -Divergences
We present the very first robust Bayesian Online Changepoint Detection algorithm through General Bayesian Inference (GBI) with $\beta$-divergences. The resulting inference procedure is doubly robust for both the predictive and the changepoint (CP) posterior, with linear time and constant space complexity. We provide a construction for exponential models and demonstrate it on the Bayesian Linear Regression model. In so doing, we make two additional contributions: Firstly, we make GBI scalable using Structural Variational approximations that are exact as $\beta \to 0$. Secondly, we give a principled way of choosing the divergence parameter $\beta$ by minimizing expected predictive loss on-line.
Sigsoftmax: Reanalysis of the Softmax Bottleneck
Softmax is an output activation function for modeling categorical probability distributions in many applications of deep learning. However, a recent study revealed that softmax can be a bottleneck of representational capacity of neural networks in language modeling (the softmax bottleneck). In this paper, we propose an output activation function for breaking the softmax bottleneck without additional parameters. We re-analyze the softmax bottleneck from the perspective of the output set of log-softmax and identify the cause of the softmax bottleneck. On the basis of this analysis, we propose sigsoftmax, which is composed of a multiplication of an exponential function and sigmoid function. Sigsoftmax can break the softmax bottleneck. The experiments on language modeling demonstrate that sigsoftmax and mixture of sigsoftmax outperform softmax and mixture of softmax, respectively.
How To Make the Gradients Small Stochastically: Even Faster Convex and Nonconvex SGD
Stochastic gradient descent (SGD) gives an optimal convergence rate when minimizing convex stochastic objectives $f(x)$. However, in terms of making the gradients small, the original SGD does not give an optimal rate, even when $f(x)$ is convex. If $f(x)$ is convex, to find a point with gradient norm $\varepsilon$, we design an algorithm SGD3 with a near-optimal rate $\tilde{O}(\varepsilon^{-2})$, improving the best known rate $O(\varepsilon^{-8/3})$. If $f(x)$ is nonconvex, to find its $\varepsilon$-approximate local minimum, we design an algorithm SGD5 with rate $\tilde{O}(\varepsilon^{-3.5})$,
Training Deep Models Faster with Robust, Approximate Importance Sampling
In practice, the cost of computing importances greatly limits the impact of importance sampling. We propose a robust, approximate importance sampling procedure (RAIS) for stochastic gradient descent. By approximating the ideal sampling distribution using robust optimization, RAIS provides much of the benefit of exact importance sampling with drastically reduced overhead. Empirically, we find RAIS-SGD and standard SGD follow similar learning curves, but RAIS moves faster through these paths, achieving speed-ups of at least 20% and sometimes much more.