Abstract:Post-Training Quantization (PTQ) compresses large language models to low bit-widths using a small calibration set, and its quality depends strongly on which samples are chosen. We identify a failure mode in which calibration samples fail to activate outlier channels, hidden dimensions with unusually large activations, causing the quantizer to underestimate their dynamic range and producing per-channel reconstruction errors that dominate layer-wise loss. Motivated by this observation, we argue that PTQ calibration quality is governed more by weighted outlier-channel coverage than by generic sample representativeness, and formulate calibration selection as a weighted set cover problem over outlier channels. The objective is monotone submodular, and the greedy algorithm, COVERCAL, operates on pre-computed activation statistics and requires no GPU time at selection. We further show that the weight choice is internally consistent: under a stylized clipping model, missed weighted coverage upper-bounds surrogate loss, justifying the weighted coverage objective as principled rather than purely empirical. Across LLaMA-2, LLaMA-3, and Mistral, under AWQ and GPTQ backends and five downstream evaluations, COVERCAL improves over random, max-perplexity, max-activation-variance, and stratified baselines, with the largest gains at small calibration budgets. At INT4 with 128 samples, COVERCAL improves MMLU by 1.2 to 1.5 points over random calibration and reduces perplexity degradation by 15 to 30\%; with 64 samples, it matches or exceeds random calibration at 256. The contribution is not a new PTQ backend but a formulation of calibration selection as weighted outlier coverage, with a simple, efficient algorithm and a surrogate-based justification.
Abstract:Continual learning for large language models is typically evaluated through accuracy retention under sequential fine-tuning. We argue that this perspective is incomplete, because uncertainty reliability can degrade earlier and more sharply than top-1 performance. We study this empirically by measuring conformal coverage and calibration error on sequentially fine-tuned models across three model families and eight task sequences drawn primarily from classification and multiple-choice benchmarks. Across the classification-style settings we study, coverage loss exceeds accuracy loss by a factor of roughly \(3.4\times \pm 0.5\times\) on average across seeds; in the most pronounced case, coverage drops from \(0.92\) to \(0.61\), while accuracy remains within three points of baseline. Standard continual-learning methods that preserve accuracy do not automatically preserve coverage, and naive calibration baselines recover only part of the gap. We propose calibration replay, a lightweight post-hoc procedure that maintains a task-specific held-out buffer and refits a task-specific conformal threshold under the current model after each update. It adds no training-time gradient cost, uses less than one percent of the memory of ordinary experience replay, and typically restores coverage to within two points of nominal at buffer size \(m = 200\). We accompany the empirical study with a drift decomposition, a finite-sample recovery theorem showing exact conformal validity under exchangeability, and a mixture-validity proposition explaining why pooled thresholds do not suffice. Our guarantees are stated for classification-style tasks with task-specific buffers; extensions to open-ended generation are exploratory.
Abstract:Majority-vote ensembles achieve variance reduction by averaging over diverse, approximately independent base learners. When training data exhibits Markov dependence, as in time-series forecasting, reinforcement learning (RL) replay buffers, and spatial grids, this classical guarantee degrades in ways that existing theory does not fully quantify. We provide a minimax characterization of this phenomenon for discrete classification in a fixed-dimensional Markov setting, together with an adaptive algorithm that matches the rate on a graph-regular subclass. We first establish an information-theoretic lower bound for stationary, reversible, geometrically ergodic chains in fixed ambient dimension, showing that no measurable estimator can achieve excess classification risk better than $Ω(\sqrt{\Tmix/n})$. We then prove that, on the AR(1) witness subclass underlying the lower-bound construction, dependence-agnostic uniform bagging is provably suboptimal with excess risk bounded below by $Ω(\Tmix/\sqrt{n})$, exhibiting a $\sqrt{\Tmix}$ algorithmic gap. Finally, we propose \emph{adaptive spectral routing}, which partitions the training data via the empirical Fiedler eigenvector of a dependency graph and achieves the minimax rate $\mathcal{O}(\sqrt{\Tmix/n})$ up to a lower-order geometric cut term on a graph-regular subclass, without knowledge of $\Tmix$. Experiments on synthetic Markov chains, 2D spatial grids, the 128-dataset UCR archive, and Atari DQN ensembles validate the theoretical predictions. Consequences for deep RL target variance, scalability via Nyström approximation, and bounded non-stationarity are developed as supporting material in the appendix.
Abstract:Crash classification models in transportation safety are typically evaluated using accuracy, F1, or AUC, metrics that cannot reveal whether a model is silently overfitting. We introduce a spectral diagnostic framework grounded in Random Matrix Theory (RMT) and Heavy-Tailed Self-Regularization (HTSR) that spans the ML taxonomy: weight matrices for BERT/ALBERT/Qwen2.5, out-of-fold increment matrices for XGBoost/Random Forest, empirical Hessians for Logistic Regression, induced affinity matrices for Decision Trees, and Graph Laplacians for KNN. Evaluating nine model families on two Iowa DOT crash classification tasks (173,512 and 371,062 records respectively), we find that the power-law exponent $α$ provides a structural quality signal: well-regularized models consistently yield $α$ within $[2, 4]$ (mean $2.87 \pm 0.34$), while overfit variants show $α< 2$ or spectral collapse. We observe a strong rank correlation between $α$ and expert agreement (Spearman $ρ= 0.89$, $p < 0.001$), suggesting spectral quality captures model behaviors aligned with expert reasoning. We propose an $α$-based early stopping criterion and a spectral model selection protocol, and validate both against cross-validated F1 baselines. Sparse Lanczos approximations make the framework scalable to large datasets.
Abstract:Correlation Clustering (CC) is a fundamental unsupervised learning primitive whose strongest LP-based approximation guarantees require $Θ(n^3)$ triangle inequality constraints and are prohibitive at scale. We initiate the study of \emph{sparsification--approximation trade-offs} for CC, asking how much edge information is needed to retain LP-based guarantees. We establish a structural dichotomy between pseudometric and general weighted instances. On the positive side, we prove that the VC dimension of the clustering disagreement class is exactly $n{-}1$, yielding additive $\varepsilon$-coresets of optimal size $\tilde{O}(n/\varepsilon^2)$; that at most $\binom{n}{2}$ triangle inequalities are active at any LP vertex, enabling an exact cutting-plane solver; and that a sparsified variant of LP-PIVOT, which imputes missing LP marginals via triangle inequalities, achieves a robust $\frac{10}{3}$-approximation (up to an additive term controlled by an empirically computable imputation-quality statistic $\overlineΓ_w$) once $\tildeΘ(n^{3/2})$ edges are observed, a threshold we prove is sharp. On the negative side, we show via Yao's minimax principle that without pseudometric structure, any algorithm observing $o(n)$ uniformly random edges incurs an unbounded approximation ratio, demonstrating that the pseudometric condition governs not only tractability but also the robustness of CC to incomplete information.
Abstract:Hybrid architectures combining state-space models with attention have achieved strong efficiency-quality tradeoffs, yet existing approaches either apply attention uniformly or learn static sparse patterns. This misses a key opportunity: \emph{attention demand should decrease over time as recurring patterns become familiar}. We present a surprising finding from analyzing GPT-2 models: \textbf{88\%} of attention operations retrieve information already predictable from the model's hidden state, and this redundancy does \emph{not} decrease during training. Motivated by this observation, we introduce \textbf{\ours{}} (\textbf{C}onsolidation-based \textbf{R}outing for \textbf{A}daptive \textbf{M}emory), a biologically inspired memory consolidation mechanism that gradually distills episodic retrievals into parametric semantic memory. Unlike prior sparse attention methods, \ours{} exhibits \emph{decreasing attention utilization} over training, achieving a \textbf{37.8$\times$} reduction through a sharp phase transition at approximately 3K steps. We prove that this capability is \emph{impossible} without consolidation: any static routing scheme requires $Ω(f \cdot n)$ attention for tasks with recurring patterns of frequency $f$. On our proposed SRCD benchmark, \ours{} achieves \textbf{100\% retrieval accuracy} at 1.6\% attention compute (vs.\ 68\% for baselines), and consolidated patterns transfer to unseen tasks with \textbf{48--52\%} attention reduction without retraining. Remarkably, the learned consolidation dynamics quantitatively match human episodic-to-semantic memory transition curves from cognitive psychology ($γ= 0.43$ vs.\ $γ_{\text{human}} \approx 0.4$--$0.5$). Code and benchmarks are available at [anonymized].
Abstract:We study black-box optimization of Lipschitz functions under noisy evaluations. Existing adaptive discretization methods implicitly avoid suboptimal regions but do not provide explicit certificates of optimality or measurable progress guarantees. We introduce \textbf{Certificate-Guided Pruning (CGP)}, which maintains an explicit \emph{active set} $A_t$ of potentially optimal points via confidence-adjusted Lipschitz envelopes. Any point outside $A_t$ is certifiably suboptimal with high probability, and under a margin condition with near-optimality dimension $α$, we prove $\Vol(A_t)$ shrinks at a controlled rate yielding sample complexity $\tildeO(\varepsilon^{-(2+α)})$. We develop three extensions: CGP-Adaptive learns $L$ online with $O(\log T)$ overhead; CGP-TR scales to $d > 50$ via trust regions with local certificates; and CGP-Hybrid switches to GP refinement when local smoothness is detected. Experiments on 12 benchmarks ($d \in [2, 100]$) show CGP variants match or exceed strong baselines while providing principled stopping criteria via certificate volume.
Abstract:Post-training activation compression is essential for deploying Large Language Models (LLMs) on resource-constrained hardware. However, standard methods like Singular Value Decomposition (SVD) are gradient-blind: they preserve high-variance dimensions regardless of their impact on factual knowledge preservation. We introduce Fisher-Aligned Subspace Compression (FASC), a knowledge-aware compression framework that selects subspaces by directly modeling activation-gradient coupling, minimizing a second-order surrogate of the loss function. FASC leverages the Fisher Information Matrix to identify dimensions critical for factual knowledge, which often reside in low-variance but high-gradient-sensitivity subspaces. We propose the Dependence Violation Score (\r{ho}) as a general-purpose diagnostic metric that quantifies activation-gradient coupling, revealing where factual knowledge is stored within transformer architectures. Extensive experiments on Mistral-7B and Llama-3-8B demonstrate that FASC preserves 6-8% more accuracy on knowledge-intensive benchmarks (MMLU, LAMA) compared to variance-based methods at 50% rank reduction, effectively enabling a 7B model to match the factual recall of a 13B uncompressed model. Our analysis reveals that \r{ho} serves as a fundamental signal of stored knowledge, with high-\r{ho} layers emerging only when models internalize factual associations during training.
Abstract:Deep protein structure predictors such as AlphaFold provide confidence estimates (e.g., pLDDT) that are often miscalibrated and degrade under distribution shifts across experimental modalities, temporal changes, and intrinsically disordered regions. We introduce CalPro, a prior-aware evidential-conformal framework for shift-robust uncertainty quantification. CalPro combines (i) a geometric evidential head that outputs Normal-Inverse-Gamma predictive distributions via a graph-based architecture; (ii) a differentiable conformal layer that enables end-to-end training with finite-sample coverage guarantees; and (iii) domain priors (disorder, flexibility) encoded as soft constraints. We derive structure-aware coverage guarantees under distribution shift using PAC-Bayesian bounds over ambiguity sets, and show that CalPro maintains near-nominal coverage while producing tighter intervals than standard conformal methods in regions where priors are informative. Empirically, CalPro exhibits at most 5% coverage degradation across modalities (vs. 15-25% for baselines), reduces calibration error by 30-50%, and improves downstream ligand-docking success by 25%. Beyond proteins, CalPro applies to structured regression tasks in which priors encode local reliability, validated on non-biological benchmarks.
Abstract:Large language models increasingly require structured inference, from JSON schema enforcement to multi-lingual parsing, where outputs must satisfy complex constraints. We introduce MetaJuLS, a meta-reinforcement learning approach that learns universal constraint propagation policies applicable across languages and tasks without task-specific retraining. By formulating structured inference as adaptive constraint propagation and training a Graph Attention Network with meta-learning, MetaJuLS achieves 1.5--2.0$\times$ speedups over GPU-optimized baselines while maintaining within 0.2\% accuracy of state-of-the-art parsers. On Universal Dependencies across 10 languages and LLM-constrained generation (LogicBench, GSM8K-Constrained), MetaJuLS demonstrates rapid cross-domain adaptation: a policy trained on English parsing adapts to new languages and tasks with 5--10 gradient steps (5--15 seconds) rather than requiring hours of task-specific training. Mechanistic analysis reveals the policy discovers human-like parsing strategies (easy-first) and novel non-intuitive heuristics. By reducing propagation steps in LLM deployments, MetaJuLS contributes to Green AI by directly reducing inference carbon footprint.