Genre
Demystifying Low-Rank Knowledge Distillation in Large Language Models: Convergence, Generalization, and Information-Theoretic Guarantees
Soarez, Alberlucia Rafael, Kim, Daniel, Costa, Mariana, Torre, Alejandro
Knowledge distillation has emerged as a powerful technique for compressing large language models (LLMs) into efficient, deployable architectures while preserving their advanced capabilities. Recent advances in low-rank knowledge distillation, particularly methods like Low-Rank Clone (LRC), have demonstrated remarkable empirical success, achieving comparable performance to full-parameter distillation with significantly reduced training data and computational overhead. However, the theoretical foundations underlying these methods remain poorly understood. In this paper, we establish a rigorous theoretical framework for low-rank knowledge distillation in language models. We prove that under mild assumptions, low-rank projection preserves the optimization dynamics, yielding explicit convergence rates of $O(1/\sqrt{T})$. We derive generalization bounds that characterize the fundamental trade-off between model compression and generalization capability, showing that the generalization error scales with the rank parameter as $O(r(m+n)/\sqrt{n})$. Furthermore, we provide an information-theoretic analysis of the activation cloning mechanism, revealing its role in maximizing the mutual information between the teacher's and student's intermediate representations. Our theoretical results offer principled guidelines for rank selection, mathematically suggesting an optimal rank $r^* = O(\sqrt{n})$ where $n$ is the sample size. Experimental validation on standard language modeling benchmarks confirms our theoretical predictions, demonstrating that the empirical convergence, rank scaling, and generalization behaviors align closely with our bounds.
Exponential Family Discriminant Analysis: Generalizing LDA-Style Generative Classification to Non-Gaussian Models
We introduce Exponential Family Discriminant Analysis (EFDA), a unified generative framework that extends classical Linear Discriminant Analysis (LDA) beyond the Gaussian setting to any member of the exponential family. Under the assumption that each class-conditional density belongs to a common exponential family, EFDA derives closed-form maximum-likelihood estimators for all natural parameters and yields a decision rule that is linear in the sufficient statistic, recovering LDA as a special case and capturing nonlinear decision boundaries in the original feature space. We prove that EFDA is asymptotically calibrated and statistically efficient under correct specification, and we generalise it to $K \geq 2$ classes and multivariate data. Through extensive simulation across five exponential-family distributions (Weibull, Gamma, Exponential, Poisson, Negative Binomial), EFDA matches the classification accuracy of LDA, QDA, and logistic regression while reducing Expected Calibration Error (ECE) by $2$-$6\times$, a gap that is structural: it persists for all $n$ and across all class-imbalance levels, because misspecified models remain asymptotically miscalibrated. We further prove and empirically confirm that EFDA's log-odds estimator approaches the Cramér-Rao bound under correct specification, and is the only estimator in our comparison whose mean squared error converges to zero. Complete derivations are provided for nine distributions. Finally, we formally verify all four theoretical propositions in Lean 4, using Aristotle (Harmonic) and OpenGauss (Math, Inc.) as proof generators, with all outputs independently machine-checked by AXLE (Axiom).
Deep Adaptive Model-Based Design of Experiments
Strouwen, Arno, Micluţa-Câmpeanu, Sebastian
Model-based design of experiments (MBDOE) is essential for efficient parameter estimation in nonlinear dynamical systems. However, conventional adaptive MBDOE requires costly posterior inference and design optimization between each experimental step, precluding real-time applications. We address this by combining Deep Adaptive Design (DAD), which amortizes sequential design into a neural network policy trained offline, with differentiable mechanistic models. For dynamical systems with known governing equations but uncertain parameters, we extend sequential contrastive training objectives to handle nuisance parameters and propose a transformer-based policy architecture that respects the temporal structure of dynamical systems. We demonstrate the approach on four systems of increasing complexity: a fed-batch bioreactor with Monod kinetics, a Haldane bioreactor with uncertain substrate inhibition, a two-compartment pharmacokinetic model with nuisance clearance parameters, and a DC motor for real-time deployment.
Bridging the Gap Between Climate Science and Machine Learning in Climate Model Emulation
Schmidt, Luca, Effenberger, Nina
While climate models provide insights for climate decision-making, their use is constrained by significant computational and technical demands. Although machine learning (ML) emulators offer a way to bypass the high computational costs, their effective use remains challenging. The hurdles are diverse, ranging from limited accessibility and a lack of specialized knowledge to a general mistrust of ML methods that are perceived as insufficiently physical. Here, we introduce a framework to overcome these barriers by integrating both climate science and machine learning perspectives. We find that designing easy-to-adopt emulators that address a clearly defined task and demonstrating their reliability offers a promising path for bridging the gap between our two fields.
Beyond the Mean: Distribution-Aware Loss Functions for Bimodal Regression
Mohammadi-Seif, Abolfazl, Soares, Carlos, Ribeiro, Rita P., Baeza-Yates, Ricardo
Despite the strong predictive performance achieved by machine learning models across many application domains, assessing their trustworthiness through reliable estimates of predictive confidence remains a critical challenge. This issue arises in scenarios where the likelihood of error inferred from learned representations follows a bimodal distribution, resulting from the coexistence of confident and ambiguous predictions. Standard regression approaches often struggle to adequately express this predictive uncertainty, as they implicitly assume unimodal Gaussian noise, leading to mean-collapse behavior in such settings. Although Mixture Density Networks (MDNs) can represent different distributions, they suffer from severe optimization instability. We propose a family of distribution-aware loss functions integrating normalized RMSE with Wasserstein and Cramér distances. When applied to standard deep regression models, our approach recovers bimodal distributions without the volatility of mixture models. Validated across four experimental stages, our results show that the proposed Wasserstein loss establishes a new Pareto efficiency frontier: matching the stability of standard regression losses like MSE in unimodal tasks while reducing Jensen-Shannon Divergence by 45% on complex bimodal datasets. Our framework strictly dominates MDNs in both fidelity and robustness, offering a reliable tool for aleatoric uncertainty estimation in trustworthy AI systems.
Overfitting and Generalizing with (PAC) Bayesian Prediction in Noisy Binary Classification
Zhu, Xiaohan, Ohannessian, Mesrob I., Srebro, Nathan
We consider a PAC-Bayes type learning rule for binary classification, balancing the training error of a randomized ''posterior'' predictor with its KL divergence to a pre-specified ''prior''. This can be seen as an extension of a modified two-part-code Minimum Description Length (MDL) learning rule, to continuous priors and randomized predictions. With a balancing parameter of $λ=1$ this learning rule recovers an (empirical) Bayes posterior and a modified variant recovers the profile posterior, linking with standard Bayesian prediction (up to the treatment of the single-parameter noise level). However, from a risk-minimization prediction perspective, this Bayesian predictor overfits and can lead to non-vanishing excess loss in the agnostic case. Instead a choice of $λ\gg 1$, which can be seen as using a sample-size-dependent-prior, ensures uniformly vanishing excess loss even in the agnostic case. We precisely characterize the effect of under-regularizing (and over-regularizing) as a function of the balance parameter $λ$, understanding the regimes in which this under-regularization is tempered or catastrophic. This work extends previous work by Zhu and Srebro [2025] that considered only discrete priors to PAC Bayes type learning rules and, through their rigorous Bayesian interpretation, to Bayesian prediction more generally.
SPDE Methods for Nonparametric Bayesian Posterior Contraction and Laplace Approximation
Alberola-Boloix, Enric, Casado-Telletxea, Ioar
We derive posterior contraction rates (PCRs) and finite-sample Bernstein von Mises (BvM) results for non-parametric Bayesian models by extending the diffusion-based framework of Mou et al. (2024) to the infinite-dimensional setting. The posterior is represented as the invariant measure of a Langevin stochastic partial differential equation (SPDE) on a separable Hilbert space, which allows us to control posterior moments and obtain non-asymptotic concentration rates in Hilbert norms under various likelihood curvature and regularity conditions. We also establish a quantitative Laplace approximation for the posterior. The theory is illustrated in a nonparametric linear Gaussian inverse problem.
Decorrelation, Diversity, and Emergent Intelligence: The Isomorphism Between Social Insect Colonies and Ensemble Machine Learning
Fokoué, Ernest, Babbitt, Gregory, Levental, Yuval
Social insect colonies and ensemble machine learning methods represent two of the most successful examples of decentralized information processing in nature and computation respectively. Here we develop a rigorous mathematical framework demonstrating that ant colony decision-making and random forest learning are isomorphic under a common formalism of \textbf{stochastic ensemble intelligence}. We show that the mechanisms by which genetically identical ants achieve functional differentiation -- through stochastic response to local cues and positive feedback -- map precisely onto the bootstrap aggregation and random feature subsampling that decorrelate decision trees. Using tools from Bayesian inference, multi-armed bandit theory, and statistical learning theory, we prove that both systems implement identical variance reduction strategies through decorrelation of identical units. We derive explicit mappings between ant recruitment rates and tree weightings, pheromone trail reinforcement and out-of-bag error estimation, and quorum sensing and prediction averaging. This isomorphism suggests that collective intelligence, whether biological or artificial, emerges from a universal principle: \textbf{randomized identical agents + diversity-enforcing mechanisms $\rightarrow$ emergent optimality}.
Algorithmic warm starts for Hamiltonian Monte Carlo
Zhang, Matthew S., Altschuler, Jason M., Chewi, Sinho
Generating samples from a continuous probability density is a central algorithmic problem across statistics, engineering, and the sciences. For high-dimensional settings, Hamiltonian Monte Carlo (HMC) is the default algorithm across mainstream software packages. However, despite the extensive line of work on HMC and its widespread empirical success, it remains unclear how many iterations of HMC are required as a function of the dimension $d$. On one hand, a variety of results show that Metropolized HMC converges in $O(d^{1/4})$ iterations from a warm start close to stationarity. On the other hand, Metropolized HMC is significantly slower without a warm start, e.g., requiring $Ω(d^{1/2})$ iterations even for simple target distributions such as isotropic Gaussians. Finding a warm start is therefore the computational bottleneck for HMC. We resolve this issue for the well-studied setting of sampling from a probability distribution satisfying strong log-concavity (or isoperimetry) and third-order derivative bounds. We prove that \emph{non-Metropolized} HMC generates a warm start in $\tilde{O}(d^{1/4})$ iterations, after which we can exploit the warm start using Metropolized HMC. Our final complexity of $\tilde{O}(d^{1/4})$ is the fastest algorithm for high-accuracy sampling under these assumptions, improving over the prior best of $\tilde{O}(d^{1/2})$. This closes the long line of work on the dimensional complexity of MHMC for such settings, and also provides a simple warm-start prescription for practical implementations.
Privacy-Preserving Reinforcement Learning from Human Feedback via Decoupled Reward Modeling
Cho, Young Hyun, Sun, Will Wei
Preference-based fine-tuning has become an important component in training large language models, and the data used at this stage may contain sensitive user information. A central question is how to design a differentially private pipeline that is well suited to the distinct structure of reinforcement learning from human feedback. We propose a privacy-preserving framework that imposes differential privacy only on reward learning and derives the final policy from the resulting private reward model. Theoretically, we study the suboptimality gap and show that privacy contributes an additional additive term beyond the usual non-private statistical error. We also establish a minimax lower bound and show that the dominant term changes with sample size and privacy level, which in turn characterizes regimes in which the upper bound is rate-optimal up to logarithmic factors. Empirically, synthetic experiments confirm the scaling predicted by the theory, and experiments on the Anthropic HH-RLHF dataset using the Gemma-2B-IT model show stronger private alignment performance than existing differentially private baseline methods across privacy budgets.