Papers

When researchers ask whether two transformer layers are "equivalent" for compression, they often conflate distinct tests. Replacement asks whether one layer's map can substitute for another's in place; interchange asks whether two layers approximately commute when their positions are swapped. Both are output-grounded swap-KL probes, but they need not agree: on pretrained transformers the protocol gap can change which layers look safe to prune by several-fold under the same evaluator, especially when replacement distances are high. We measure both protocols across checkpoints and architectures. On a Pythia training trajectory (410M and 1.4B), the replacement-interchange gap grows from initialization to convergence. Under one matched WikiText-2 contract at 8B scale, Qwen3-8B enters a divergent regime: interchange-guided removal is several-fold safer than replacement-guided at the same layer budgets, while Llama-3.1-8B ties the two protocols for pruning cost even though interchange KL is lower, showing metric gaps need not map one-to-one to removal. Before layer removal or merging, score both swap-KLs on the target checkpoint; the diagnostic requires only unlabeled forward passes.

Can LLM agents improve decision-making through self-generated memory without gradient updates? We propose FORGE (Failure-Optimized Reflective Graduation and Evolution), a staged, population-based protocol that evolves prompt-injected natural-language memory for hierarchical ReAct agents. FORGE wraps a Reflexion-style inner loop, where a dedicated reflection agent (using the same underlying LLM, no distillation from a stronger model) converts failed trajectories into reusable knowledge artifacts: textual heuristics (Rules), few-shot demonstrations (Examples), or both (Mixed), with an outer loop that propagates the best-performing instance's memory to the population between stages and freezes converged instances via a graduation criterion. We evaluate on CybORG CAGE-2, a stochastic network-defense POMDP at a 30-step horizon against the B-line attacker, where all four tested LLM families (Gemini-2.5-Flash-Lite, Grok-4-Fast, Llama-4-Maverick, Qwen3-235B) exhibit strongly negative, heavy-tailed zero-shot rewards. Compared against both a zero-shot baseline and a Reflexion baseline (isolated single-stream learning), FORGE improves average evaluation return by 1.7-7.7$\times$ over zero-shot and by 29-72% over Reflexion in all 12 model-representation conditions, reducing major-failure rates (below $-100$) to as low as $\sim$1%. We find that (1) population broadcast is critical mechanism, with a no-graduation ablation confirming that broadcast carries the performance gains while graduation primarily saves compute; (2) Examples achieves the strongest returns for three of four models, Rules offers the best cost-reliability profile with $\sim$40% fewer tokens; and (3) weaker baseline models benefit disproportionately, suggesting FORGE may mitigate capability gaps rather than amplify strong models. All evidence is confined to CAGE-2 B-line; cross-family findings are directional evidence.

The accelerating convergence of smart metering, generative artificial intelligence, and quantum-inspired combinatorial optimisation is reshaping how energy utilities manage physical infrastructure, customer engagement, and environmental accountability

Magnetic order is a fundamental property of materials, governing collective behavior and enabling a broad range of functionalities. Yet magnetic structure remains difficult to determine: experiments are costly and specialized, while first-principles methods often struggle with the noncollinear and incommensurate orders found in real materials. Here we introduce magnetic structure network (MSN), an E(3) equivariant graph neural network that predicts both collinear and non-collinear magnetic structures directly from atomic crystal structures, trained directly on experimentally determined structures from MAGNDATA. By proposing the primitive modulated structure representation (PMSR), we are able to encode commensurate and incommensurate structures in a unified way without symmetry assumptions. The model achieves strong performance across all modulation components and reconstructs experimental magnetic structures with high fidelity. Our approach provides a scalable framework for rapid magnetic structure prediction and opens a route to data-driven discovery of magnetic materials.

Aphasias, selective language impairments which can arise from brain damage, reveal the functional organization of human language by providing causal links between affected brain regions and specific symptom profiles. Drawing on this literature, we introduce an aphasia-inspired technique to characterize the emergent functional organization of language models (LMs). We “lesion” (zero-out) model parameters and measure the effects of this intervention against clinical aphasia symptoms, as diagnosed by the Text Aphasia Battery (TAB). When applied to 112,426 outputs from five 1B-scale LMs, the full range of evaluated symptoms surface, but in distributions largely distinct from those of humans. Our method uncovers broad symptom-profile differences between attention components (query, key, value, output) and feed-forward components (up, gate, down), with weaker evidence for differences among components within the same mechanism. We also find an effect of depth, where lesions in early layers disproportionately cause syntactic and semantic symptoms while late-middle layers yield higher rates of phonological and fluency deficits. Although some LM lesions induce quantitatively more similar profiles to some human aphasia types than others, qualitative differences in symptom patterns between LMs and humans suggest that aphasia syndromes are heavily influenced by the details of learning and processing rather than being a domain-invariant consequence of disrupted language processing.

Differential privacy changes the effective sample size governing CVaR learning. For tail mass $\tau$, the privacy-relevant sample size is not $n$, but $n\tau$; equivalently, the effective private tail sample size is $\epsilon n\tau$. Private CVaR excess risk decomposes into ordinary tail-risk statistical error and a privacy price. This decomposition is complete for scalar estimation and finite classes: scalar estimation has rate $\Theta(B \min\{1,(n\tau)^{-1/2}+(\epsilon n\tau)^{-1}\})$, and finite classes of size $M$ have rate $\Theta(B \min\{1,\sqrt{\log(2M)/(n\tau)}+\log(2M)/(\epsilon n\tau)\})$. These complete rates hold under pure DP, and their lower bounds extend to approximate DP in the stated small-$\delta$ regimes. For convex Lipschitz learning, modular upper and lower reductions show that the CVaR-specific privacy term necessarily scales as $1/(\epsilon n\tau)$, with dimension dependence inherited from private stochastic convex optimization. Together, these results identify ordinary private learning on $\Theta(n\tau)$ informative tail records as the canonical hard subproblem inside private CVaR learning.

Traditional scientific modeling typically begins with fixed, instance-wise effective equations and then carries out equation-specific analysis and computation, a procedure that becomes exceptionally challenging in complex applications such as multiscale systems. We propose an alternative paradigm by learning mesoscopic dynamics within a mathematically constrained hypothesis class. Building upon a generalized Onsager principle, we introduce a unified framework encompassing both dissipative and conservative mesoscopic dynamics. We establish uniform and a priori theoretical guarantees, including global well-posedness, asymptotic stability, unique factorization identifiability, and discrete energy dissipation, applicable to all spatio-temporal evolution equations within this hypothesis class prior to all learning stages. Data from each problem instance is then used to guide the identification of members within our hypothesis class, giving rise to accurate, robust and interpretable dynamical models. We empirically validate this framework on both data from continuum PDE models as a check, and on data arising from microscopic chain models for which exact meso-scale models are unknown. The proposed approach not only acts as an effective dynamics learner, but also offers vital interpretable diagnostics of the underlying physics.

Flexible continuous-time survival modeling is critical for capturing complex time-varying hazard dynamics in high-dimensional data; however, training such models remains challenging due to the intractable integral required for likelihood estimation. We introduce QSurv, a scalable deep learning framework that enables nonparametric continuous-time modeling without relying on time discretization or restrictive distributional assumptions. We propose a training objective based on Gauss-Legendre numerical quadrature, which approximates the cumulative hazard with high-order accuracy while facilitating efficient end-to-end training via standard backpropagation. Furthermore, to effectively capture non-stationary hazard dynamics in complex architectures, we introduce time-conditioned low-rank adaptation, a mechanism that conditions general neural backbones on time by dynamically modulating weights via low-rank updates. We provide theoretical analysis establishing approximation error bounds for cumulative-hazard evaluation. Comprehensive experiments across synthetic benchmarks, large-scale real-world tabular datasets, and high-dimensional medical imaging tasks demonstrate that QSurv achieves competitive predictive performance with advantages in instantaneous hazard function estimation, enabling more interpretable characterization of time-varying risk patterns.

Deploying compound LLM agents in adversarial, partially observable sequential environments requires navigating several design dimensions: (1) what the agent sees, (2) how it reasons, and (3) how tasks are decomposed across components. Yet practitioners lack guidance on which design choices improve performance versus merely increase inference costs. We present a controlled study of compound LLM agent design in CybORG CAGE-2, a cyber defense environment modeled as a Partially Observable Markov Decision Process (POMDP). Reward is non-positive, so all configurations operate in a failure-mitigation mode. Our evaluation spans five model families, six models, and twelve configurations (3,475 episodes) with token-level cost accounting. We vary context representation (raw observations vs. a deterministic state-tracking layer with compressed history), deliberation (self-questioning, self-critique, and self-improvement tools, with optional chain-of-thought prompting), and hierarchical decomposition (monolithic ReAct vs. delegation to specialized sub-agents). We find that: (1) Programmatic state abstraction delivers the largest returns per token spent (RPTS), improving mean return by up to 76% over raw observations. (2) Distributing deliberation tools across a hierarchy degrades performance relative to hierarchy alone for all five model families, reaching up to 3.4$\times$ worse mean return while using 1.8-2.7$\times$ more tokens. We call this destructive pattern a deliberation cascade. (3) Hierarchical decomposition without deliberation achieves the best absolute performance for most models, and context engineering is generally more cost-effective than deliberation. These findings suggest a design principle for structured adversarial POMDPs: invest in programmatic infrastructure and clean task decomposition rather than deeper per-agent reasoning, as these strategies can interfere when combined.

We examine one particular dimension of AI governance: how to monitor and audit AI-enabled products and services throughout the AI development lifecycle, from pre-deployment testing to post-deployment auditing. Combining principles from formal methods with SoTA machine learning, we propose techniques that enable AI-enabled product and service developers, as well as third party AI developers and evaluators, to perform offline auditing and online (runtime) monitoring of product-specific (temporally extended) behavioral constraints such as safety constraints, norms, rules and regulations with respect to black-box advanced AI systems, notably LLMs. We further provide practical techniques for predictive monitoring, such as sampling-based methods, and we introduce intervening monitors that act at runtime to preempt and potentially mitigate predicted violations. Experimental results show that by exploiting the formal syntax and semantics of Linear Temporal Logic (LTL), our proposed auditing and monitoring techniques are superior to LLM baseline methods in detecting violations of temporally extended behavioral constraints; with our approach, even small-model labelers match or exceed frontier LLM judges. Our predictive and intervening monitors significantly reduce the violation rates of LLM-based agents while largely preserving task performance. We further show through controlled experiments that LLMs' temporal reasoning shows a pronounced degradation in accuracy with increasing event distance, number of constraints, and number of propositions.

Second-order methods offer an attractive path toward more sample-efficient LLM training, but their practical use is often blocked by the systems cost of maintaining and updating large matrix-based optimizer states. We introduce Asteria, a runtime system designed to remove this bottleneck by separating second-order optimization logic from the critical GPU training path. Rather than keeping all preconditioner state on the accelerator, Asteria dynamically distributes optimizer state across GPU memory, CPU memory, and optional NVMe storage according to architectural constraints and runtime pressure. It further uses training hooks to prepare shadow states in advance, allowing expensive inverse-root computations to proceed asynchronously on the host while GPU computation continues. For distributed training, Asteria employs a bounded-staleness protocol that limits synchronization frequency while preserving optimizer effectiveness through topology-aware coordination. We evaluate Asteria on both memory-constrained and distributed training settings. On a DGX Spark platform with a single GB10 GPU and 128GB unified memory, Asteria supports second-order training for a 1B-parameter language model. On multi-node GH200 systems, it lowers visible optimizer overhead, reduces recurring latency spikes, accelerates convergence in wall-clock time, and maintains the optimization advantages of SOAP and KL-Shampoo in a 7B-parameter language model. Our results suggest that second-order LLM training can be made practical not by simplifying the optimizer alone, but by rethinking how optimizer state, background computation, and distributed synchronization are managed at the runtime level.

Pediatric critical care is a dynamic, high-stakes process involving constant monitoring and adjustments in life-saving treatments. Modeling these interventions is crucial for effective decision support. To address the challenges of high complexity and data scarcity in pediatric Extracorporeal Membrane Oxygenation (ECMO), we frame clinical decision-making as learning to act from trajectories, i.e., imitation learning that learns action models from observational data, with a key feature that actions are not directly observed. We consider TabPFN, a recent transformer-based approach for tabular data, and traditional baselines including XGBoost and Multi-Layer Perceptrons(MLPs) on real-world pediatric ECMO data to learn the action models. We find that the TabPFN-based approach consistently outperforms these classical baselines, supporting its use as a strong clinician-behavior baseline for pediatric ECMO decision support.

Real-world control systems frequently operate under piecewise stationary conditions, where dynamics remain stable for extended periods before undergoing abrupt regime changes. Standard robust RL methods face a fundamental dilemma: a globally conservative policy wastes performance during stable periods, while a locally adaptive policy risks catastrophic failure when the regime changes undetected. We propose BAPR (Bayesian Amnesic Piecewise-Robust SAC), which unifies Bayesian Online Change Detection (BOCD) with robust ensemble RL. The BAPR operator – a convex combination of mode-conditional Bellman operators weighted by a frozen belief distribution – is a $\gamma$-contraction. A complementary counterexample, machine-verified in Lean~4, establishes a sharp boundary: when beliefs depend on the Q-function, the contraction factor becomes $\gamma + \lambda\Delta$ (where $\Delta$ is the mode reward gap), and contraction fails exactly when $\gamma + \lambda\Delta \geq 1$. We derive a component-wise formal error budget for the abstract operator – every component machine-verified – bounding post-switch recovery; the budget applies to the abstract mode-mixture operator and inherits to the implemented shared-critic algorithm only through the frozen-parameter design intuition. All results are formally verified with no sorry (1,145 lines across 3 Lean~4 files, 22 machine-verified theorems). BOCD drives an adaptive conservatism mechanism: the policy becomes maximally conservative after detected change-points and smoothly relaxes as confidence grows, with detection delay $O(\log(1/\delta))$. A context-conditioning module trained via RMDM loss provides mode-aware representations from simulator-provided mode IDs at training time and requires no mode labels at deployment.

Despite their ubiquity, variational autoencoders (VAEs) inherently suffer from posterior collapse, a failure mode in which latent variables are effectively ignored. This failure arises because explicit prior imposition drives optimization toward loss landscape regions corresponding to uninformative latent representations. Here, we introduce Entropic Autoencoders (EAEs), a framework in which reconstruction loss is the only explicit objective, and entropy generates the latent variables' prior implicitly through a free energy-minimizing ensemble of encoders. This ensemble biases learning toward high-volume regions of near-optimal solutions, while decoder updates direct the search trajectories toward informative latent representations. We demonstrate that EAEs mitigate posterior collapse by learning non-Gaussian, multimodal latent distributions that yield diverse, data-consistent generations and preserve different forms of underlying structure in the data. As a proof-of-concept, we show that an EAE captures a superposition of the known low-dimensional dynamics of a reaction-diffusion process. Then, we show that an EAE identifies implicit categorical distinctions in MNIST latent representations, and displays a hierarchical understanding of facial structure on the CelebA dataset, from an "all-human" face to individual-dependent features.

Skillful medium-range precipitation forecasting at kilometer scale remains challenging over complex terrain because precipitation arises from multiscale nonlinear processes that global models cannot explicitly resolve at affordable cost. Global AI weather models can produce skillful medium-range forecasts, but their native 0.25 degrees resolution limits direct use for local hazard applications. Statistical downscaling can help bridge this gap, yet existing approaches often struggle with state-dependent, and especially lead-time-dependent, biases in global forecasts. We introduce SwAIther-Precip, a lead-time-aware downscaling framework that converts coarse-resolution AIFS forecasts into probabilistic km-scale precipitation fields over Switzerland. First, a U-Net conditioned on lead time via feature-wise linear modulation deterministically corrects systematic biases at coarse resolution. This targeted correction enables a cheaper super-resolution stage conditioned only on corrected precipitation, allowing direct training on observations rather than on the full atmospheric state. A diffusion-based model then generates fine-scale spatial variability independently of lead time. Using AIFS forecasts and CombiPrecip radar-gauge observations, SwAIther-Precip reduces CRPS by 48% relative to raw AIFS. The generated fields reproduce observed spatial variability with spectral fidelity above 0.85 at large scales and 0.88 at small scales, corresponding to an effective resolution of approximately 4 km on a 1 km grid for lead times up to 5 days. Training across lead times further improves long-range performance, yielding a 13% CRPS reduction at 6 days relative to lead-time-specific models. These results show that explicitly correcting lead-time-dependent biases before generative super-resolution is key to efficient km-scale probabilistic downscaling of global AI precipitation forecasts.

Reinforcement learning (RL) allows vision-language-action (VLA) policies to generalize beyond their training distribution by optimizing directly for task success, but post-training is computationally expensive. A natural response has been to speed rollout collection through faster simulators and world models. In GRPO-based VLA RL, we find that the dominant cost lies elsewhere: gradient computation accounts for approximately 78% of wall-clock time per step in our runs, while rollout collection accounts for only 21%. Gradient cost dominates because much of this computation is spent on phases that contribute little to learning. GRPO's learning signal is driven by advantage variance: only phases where successful and failed rollouts diverge produce learning signal. However, GRPO assigns the same advantage to every chunk in a rollout. As a result, actor-update compute is spent uniformly across the trajectory, including phases the policy already handles after pre-training and supervised fine-tuning. This paper presents Probabilistic Chunk Masking (PCM), a drop-in modification to GRPO that allocates gradient computation to a small, probabilistically selected subset of chunks per trajectory. PCM scores semantic phases using success-failure action variance, a rollout-derived proxy for per-phase gradient variance, and samples a fixed chunk budget with online-updated phase-level keep probabilities. We formalize per-phase gradient variance as the quantity determines where gradient computation is useful and show that success-failure action variance provides a measurable proxy for it. PCM requires no reward model or learned critic. On three LIBERO benchmarks, PCM matches the final success rate of standard GRPO while achieving 2.38 times wall-clock speedup, 4.8 times faster gradient updates, and 60% lower peak activation memory, while backpropagating through fewer than 20% of trajectory chunks.

We develop a skew-adaptive extension of split conformal prediction for regression. The method starts from an asymmetric interval family centered at a point prediction and uses the gauge approach to deduce the conformity score induced by this family. The inverse hyperbolic sine transform of signed scaled residuals provides the training target for an additional predictive model, whose role is to learn how predictive uncertainty should tilt across the feature space. The resulting procedure preserves the finite-sample marginal validity of split conformal prediction under exchangeability, while producing intervals that adapt to both local scale and local skewness. We also develop a calibration-sample-based estimator for comparing the expected relative future width of the skew-adaptive and classical scaled-score intervals. Experiments on a variety of datasets indicate gains in prediction interval efficiency over the scaled-score construction and conformalized quantile regression, and show that the proposed estimator closely matches the corresponding average width ratio observed on the test sample.

LLMs have shown impressive success in program synthesis, discovering programs that surpass prior solutions. However, these approaches rely on simple numeric scores to signal program quality, such as the value of the solution or the number of passed tests. Because a score offers no guidance on why a program failed, the system must generate and evaluate many candidates hoping some succeed, increasing LLM inference and evaluation costs. We study a different approach: property-guided LLM program synthesis. Instead of scoring programs after evaluation, we check whether a candidate satisfies a formally defined property. When the property is violated, we stop the evaluation early and provide the LLM with a concrete counterexample showing exactly how the program failed. This feedback drastically reduces both the number of program generations and the evaluation cost, and can guide the LLM to generate stronger programs. We evaluate this approach on PDDL planning domains, asking the LLM to synthesize direct heuristic functions: every state reachable by strictly improving transitions has a strictly improving successor. A heuristic with this property leads hill-climbing algorithm directly to a goal state. A counterexample-guided repair loop generates one candidate program, checks the property over a training set, and returns the first case that violates the property. We evaluate our approach on ten planning domains with an out-of-distribution test set. The synthesized heuristics are effectively direct on virtually all test tasks, and compared to the best prior generation method our approach generates seven times fewer programs per domain on average, solves more tasks without using search, and requires several orders of magnitude less computation to evaluate candidates. Whenever a problem admits a verifiable property, property-guided LLM synthesis can reduce cost and improve program quality.

Neural architecture search (NAS) is a powerful approach for automating model design, but existing methods often optimize for accuracy alone or rely on proxy metrics such as bit operations (BOPs) that correlate poorly with hardware cost. This gap is particularly large for FPGA deployment, where cost is dominated by a multi-dimensional budget of lookup tables, DSPs, flip-flops, BRAM, and latency. We present the Surrogate Neural Architecture Codesign Package (SNAC-Pack), an open-source AutoML framework for hardware-aware neural architecture codesign and end-to-end FPGA deployment. SNAC-Pack runs a multi-objective global search with Optuna and NSGA-II, loading trials to a shared SQLite store that enables parallel workers across compute nodes. A hardware surrogate model outputs per-trial resource and latency estimates, avoiding the synthesis cost that would otherwise dominate the search loop. A local search stage then applies quantization-aware training (QAT) together with iterative magnitude pruning in a combined compression loop, after which the final model is synthesized to FPGA firmware via the hls4ml Python library. A YAML configuration and an optional agentic frontend let users run the pipeline on new datasets without modifying the framework. We demonstrate SNAC-Pack on jet classification at the Large Hadron Collider and superconducting qubit readout, discovering compact Pareto-optimal architectures that either match baseline task performance while reducing FPGA resource utilization or substantially reduce hardware utilization with only modest decreases in task performance. In the qubit readout case, SNAC-Pack also reduces the design space exploration process from months of manual fine-tuning to hours of automated search.

Sharpness-aware minimization (SAM) encourages flat minima by perturbing parameters along directions of high loss curvature, but treats all parameter directions uniformly, ignoring the underlying loss geometry. We introduce LLQR+SAM, which combines SAM with a learned preconditioner obtained from the recently proposed LLQR framework, a second-order method that recasts steepest descent as a layerwise linear-quadratic regulator problem. The preconditioner is updated sparsely and maintained as a slow exponential moving average, so it captures a smoothed, low-resolution picture of the loss landscape geometry. The SAM perturbation then operates on top of this learned geometry, probing curvature at a faster timescale. We show that this two-timescale structure is not merely a computational convenience: theoretically, the preconditioner amplifies the SAM escape signal in directions that are flat under the average geometry but locally sharp (potholes). Wide, flat basins, by contrast, remain stable. Empirically, LLQR+SAM gives consistent gains over both SAM and LLQR alone across standard vision and sequence modeling benchmarks, supporting the view that slow learned geometry and fast sharpness correction are genuinely complementary.

For a fixed flow-based generative model under a small inference budget, sample quality can depend strongly on where the sampler spends its few function evaluations. Flow matching and Schrödinger bridges define probability paths, yet their inference grids are usually heuristic or inherited from one-endpoint diffusion. We derive a conditional-marginal entropy-rate objective for bridge-aware discretization, separating endpoint-conditioned bridge geometry from marginal flow evolution, and use it to build a training-free entropic inference-time scheduler from first principles. For Gaussian Brownian bridges this rate is closed-form and U-shaped, motivating boundary-heavy nonuniform grids. On trained two-dimensional bridge/flow models, the estimated profile recovers the predicted shape and improves 10-step ODE-Heun MMD over linear by 18.1%, with a paired 22.7% SDE-Heun improvement in the same low-NFE sweep. On EDM/CIFAR-10, the entropic time-discretization gives the best tested five-step FID (186.3 \pm 4.0 versus 200.5 \pm 2.9 for linear and 238.0 \pm 5.3 for cosine). On AlphaFlow protein generation, entropic conditional-marginal (cond-marg) scheduling shows advantage in low-NFE regimes on both CAMEO22 and ATLAS benchmarks. These results support entropy-rate scheduling as a practical low-budget allocation signal for high-dimensional bridge and flow samplers.

The source distribution in conditional flow matching is a design parameter that can be calibrated to data, not a default isotropic prior. We exploit this in Multi-Fidelity Flow Matching (MFFM), a cascade refinement framework for parametric PDE solutions: the source is calibrated to the empirical low-to-high-fidelity residual scale with local Gaussian-blur correlation, and the velocity network is conditioned on the low-fidelity solution. Conditioning makes the residual refinement problem substantially easier than unconditional field generation, while residual-calibrated source noise improves the flow-matching training geometry. A multi-resolution cascade applies the same construction independently between adjacent fidelities. After level-wise flow-matching pretraining, we fine-tune the composed cascade end-to-end with a deterministic one-step rollout, which makes one velocity evaluation per cascade level the optimized operating point at inference. The result is a learned analog of multigrid refinement that reaches the finest grid in $L$ deterministic network evaluations per query. We validate MFFM on eight benchmarks: two super-resolution problems and six spatiotemporal forecasting tasks from PDEBench, The Well, and the FNO Navier–Stokes dataset.

We propose a scalable neuromorphic architecture based on spiking dynamics emerging from the autonomous time-continuous evolution of clockless (asynchronous) digital circuits. Implemented on commercially available field-programmable gate arrays (FPGAs), our system implements networks of interacting Boolean spiking neurons with configurable excitatory and inhibitory synaptic weights. A complete processing pipeline enables efficient handling of spike-encoded data for solving machine-learning tasks. We demonstrate competitive performance for an audio classification task with spike-based encoding and high-speed processing. Power consumption is significantly lower than traditional digital implementations; this makes our approach an efficient alternative that bridges the gap to dedicated analog neuromorphic systems without the need for specialized hardware design. More generally, our approach establishes clockless digital hardware as a viable platform for neuromorphic computing. It paves the way for reconfigurable chips to be turned into energy-efficient quasi-analog neuromorphic processors.

Transformer-based architectures have become the dominant paradigm for Continuous-Time Dynamic Graph (CTDG) learning, yet their performance remains limited on temporally shifted datasets. In this work, we identify attention dispersion as a shared failure mode of dynamic graph Transformers under temporal distribution shift. Through controlled ablation contrasting structurally and temporally distinguished historical neighbors against random ones, we show that prediction depends on a class of critical nodes that carry consistently more predictive signal than arbitrary neighbors. However, existing Transformers fail to focus on these nodes even when they are present in the input, as temporal shift weakens attention contrast and produces overly dispersed attention distributions. This diagnosis suggests a simple and transferable fix: replace standard attention with differential attention, which suppresses common-mode attention and amplifies distinctive token-level signals. When added to three representative CTDG Transformer baselines, differential attention consistently improves performance, with gains concentrated on high-shift datasets. Attention-level measurements further confirm the mechanism, showing reduced attention entropy and increased attention mass on critical nodes. Building on these findings, we introduce DiffDyG, a reference implementation combining differential attention with standard input encodings. Across 9 benchmarks and three negative sampling protocols, DiffDyG achieves SOTA performance, with especially large gains on the most shifted datasets.

Federated Learning (FL) enables collaborative training across decentralized clients, but most methods assume aligned feature schemas, an assumption that rarely holds in tabular settings where clients observe only partially overlapping feature subsets. In these heterogeneous feature spaces, parameter-averaging methods (e.g., FedAvg) transfer little information across weakly overlapping or disjoint feature groups, limiting their effectiveness for federated imputation. To overcome this, we propose FedHF-Impute, a federated imputation framework that separates structural feature unavailability from conventional missingness and uses a shared global feature graph to propagate information across statistically related features through message passing. This enables indirect cross-client knowledge transfer, even when features are never jointly observed locally, while preserving standard federated communication. Under simulated partial schema overlap on the SECOM and AirQuality datasets, FedHF-Impute improves imputation accuracy (RMSE) over FL baselines by 26.9%, and 8.4% respectively, while achieving comparable performance on PhysioNET, with only a 0.3% difference relative to the best baseline.

Federated Learning (FL) has emerged as a promising paradigm for collaborative model training across distributed edge devices while preserving data privacy especially with the huge increase amount of data due to the adoption of technologies which contributes to the growing number of IoT devices. Storing this amount of data centrally is challenging due to issues like limited communication, privacy, and regulations. FL can be Centralized (CFL), Decentralized (DFL), and Semi-decentralized (SDFL). Choosing the right FL architecture depends on the application's needs. However, very few research studies have experimentally compared these three types of architectures to not only understand the respective strengths and limitations, but also trade-offs between different performance indicators. This paper overcome this lack of analysis, conducting experimental analyses using the Fedstellar simulator, MNIST dataset, and MLP classifier.

Self-supervised pretraining on molecular graphs has emerged as a promising approach for molecular property prediction, yet most existing methods operate at a single structural granularity and treat bond information as auxiliary edge attributes rather than as an independent semantic layer. In this work, we propose MolCHG, a multi-level self-supervised pretraining framework built upon a novel Compositional Hierarchical Graph that organizes molecular structure into four types of nodes across three semantic levels. By introducing a bond graph that operates in parallel with the atom graph, our architecture elevates bond-level information to independently evolving node representations, enabling fragment nodes to aggregate atom-level and bond-level semantics on an equal footing. We design three level-specific pretraining objectives: an atom-bond cross-view contrastive task that aligns the atom-view and bond-view representations within each fragment, a fragment-level functional group prediction task to inject domain-relevant chemical knowledge, and graph-level structure prediction tasks to encode global molecular topology. Experiments on nine MoleculeNet benchmarks demonstrate that MolCHG achieves the best performance on seven datasets across both classification and regression tasks, remaining competitive with the strongest baselines on the rest. Ablation studies further confirm that the multi-level supervision signals are complementary and that each component contributes to the overall performance.

The paradigm of learning from automatic annotations driven by pre-trained experts and Foundation Models dominates data-hungry applications. However, it introduces a critical challenge: model-induced label noise. Unlike stochastic noise in classical robust learning, this noise stems from annotator inductive biases, manifesting as systematic errors tightly coupled with local feature manifolds. Existing methods relying on global transition matrices underfit these structural patterns, while learning instance-specific matrices remains mathematically intractable. We propose Model-Induced Noise Decoupling (MIND), a theoretically grounded framework addressing this dilemma. We demonstrate that the high-dimensional noise manifold can be decoupled into tractable, subspace-dependent components via Latent Manifold Disentanglement. Specifically, our Latent Decoupling Estimator (LDE) dynamically projects samples into latent structural clusters with consistent error modes, facilitating noise identifiability without ground-truth anchor points. To rigorously evaluate robustness, we adopt a hierarchical protocol: moving from controlled noise on CIFAR-100 to a structural stress test on large-scale real-world 3D datasets (S3DIS, ScanNet), where error patterns explicitly couple with geometric manifolds. Empirically, MIND significantly outperforms state-of-the-art methods on these complex benchmarks and effectively corrects zero-shot hallucinations from Vision-Language Models (e.g., OpenSeg), highlighting its potential as a robust distillation framework for Foundation Models.

Neural network surrogate models have emerged as a promising approach to model solution fields for a wide variety of boundary value problems encountered in physical modeling. Stochastic problems represent an area of particularly high interest because of the potential to significantly reduce the repeated evaluation of expensive forward models via traditional numerical solvers when conducting parametric analysis. However, many studies found in the literature primarily focus on the ability of neural network surrogate models to represent deterministic samples or mean field solutions and largely overlook surrogate model performance at the tails of the distribution. The present study examines in detail the ability of neural network surrogate models to capture the full distribution of solution fields over the entire probability space, while emphasis is placed at the tails of the distribution. Serving as a canonical problem is the heat conduction equation with a highly stochastic source term, inducing extremely large variation in the thermal solution field. Comparisons are made between a classic feed-forward fully connected network and a Deep Operator Network architecture, using both data-driven and physics-informed loss functions. Results show that the worst-case prediction errors are an order of magnitude larger than the mean field error, highlighting the importance of the outlier samples. The large errors associated with extreme samples result from the networks having to extrapolate beyond the bounds of the training data. A method for identifying these samples is presented along with a discussion of potential approaches to account of their errors. Among the models considered, the fully connected neural network trained using a weak form residual loss performs best in handling these extrapolated inputs, achieving the highest prediction accuracy for the numerically produced datasets.

Timeseries regression models often struggle to leverage large volumes of labeled multimodal data, particularly when the data are irregularly sampled or contain missing values. This is common in domains like healthcare and predictive maintenance, where data are collected from unreliable sources, and labeling requires expert knowledge or costly equipments. Transformer-based large language models have proven effective on structured data such as text through self-supervised learning (SSL) and generative pretraining (GPT) frameworks. However, such models lack the flexibility to efficiently process irregularly sampled multimodal timeseries data. In this paper, we introduce ITGPT, an attention-based architecture designed for handling multimodal, irregularly sampled timeseries by allowing training with both SSL losses and GPT-like objectives. We evaluate its performance on a healthcare task with the TIHM dataset, and a predictive maintenance task with the CompX dataset. Our results demonstrate that ITGPT achieves state-of-the-art performance without requiring resampling, feature fusion or explicit data imputation. Furthermore, when labels are scarce, ITGPT effectively leverages unlabeled data through SSL and GPT training, outperforming the purely supervised approach. This represents an important step towards efficiently using large and unstructured timeseries datasets for practical inference tasks.