latent function
Generating Full-field Evolution of Physical Dynamics from Irregular Sparse Observations
Modeling and reconstructing multidimensional physical dynamics from sparse and off-grid observations presents a fundamental challenge in scientific research. Recently, diffusion-based generative modeling shows promising potential for physical simulation. However, current approaches typically operate on on-grid data with preset spatiotemporal resolution, but struggle with the sparsely observed and continuous nature of real-world physical dynamics. To fill the gaps, we present SDIFT, Sequential DIffusion in Functional Tucker space, a novel framework that generates full-field evolution of physical dynamics from irregular sparse observations. SDIFT leverages the functional Tucker model as the latent space representer with proven universal approximation property, and represents observations as latent functions and Tucker core sequences. We then construct a sequential diffusion model with temporally augmented UNet in the functional Tucker space, denoising noise drawn from a Gaussian process to generate the sequence of core tensors. At the posterior sampling stage, we propose a Message-Passing Posterior Sampling mechanism, enabling conditional generation of the entire sequence guided by observations at limited time steps. We validate SDIFT on three physical systems spanning astronomical (supernova explosions, light-year scale), environmental (ocean sound speed fields, kilometer scale), and molecular (organic liquid, millimeter scale) domains, demonstrating significant improvements in both reconstruction accuracy and computational efficiency compared to state-of-the-art approaches.
PerSim: Data-Efficient Offline Reinforcement Learning with Heterogeneous Agents via Personalized Simulators
We consider offline reinforcement learning (RL) with heterogeneous agents under severe data scarcity, i.e., we only observe a single historical trajectory for every agent under an unknown, potentially sub-optimal policy. We find that the performance of state-of-the-art offline and model-based RL methods degrade significantly given such limited data availability, even for commonly perceived solved benchmark settings such as MountainCar and CartPole. To address this challenge, we propose PerSim, a model-based offline RL approach which first learns a personalized simulator for each agent by collectively using the historical trajectories across all agents, prior to learning a policy. We do so by positing that the transition dynamics across agents can be represented as a latent function of latent factors associated with agents, states, and actions; subsequently, we theoretically establish that this function is well-approximated by a low-rank decomposition of separable agent, state, and action latent functions. This representation suggests a simple, regularized neural network architecture to effectively learn the transition dynamics per agent, even with scarce, offline data. We perform extensive experiments across several benchmark environments and RL methods. The consistent improvement of our approach, measured in terms of both state dynamics prediction and eventual reward, confirms the efficacy of our framework in leveraging limited historical data to simultaneously learn personalized policies across agents.
Multi-fidelity Batch Active Learning for Gaussian Process Classifiers
Cutforth, Murray, Yang, Yiming, Fan, Tiffany, Guillas, Serge, Darve, Eric
Many science and engineering problems rely on expensive computational simulations, where a multi-fidelity approach can accelerate the exploration of a parameter space. We study efficient allocation of a simulation budget using a Gaussian Process (GP) model in the binary simulation output case. This paper introduces Bernoulli Parameter Mutual Information (BPMI), a batch active learning algorithm for multi-fidelity GP classifiers. BPMI circumvents the intractability of calculating mutual information in the probability space by employing a first-order Taylor expansion of the link function. We evaluate BPMI against several baselines on two synthetic test cases and a complex, real-world application involving the simulation of a laser-ignited rocket combustor. In all experiments, BPMI demonstrates superior performance, achieving higher predictive accuracy for a fixed computational budget.
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First provide a summary of the paper, and then address the following criteria: Quality, clarity, originality and significance. The authors present a model for latent functions in regression with which exact inference is possible if the likelihood function is chosen from an exponential family. The latent function is selected with the imposition of a smoothness constraint on a kernel function (of the covariates), which is chosen with information theoretic methods relating proposal distributions. I think the procedure is well motivated with the intention of sacrificing the general flexibility of Gaussian processes for a very favorable complexity of inference. I think the construction of the model and model selection methods are very clean and intuitive.