Uncertainty
Sampling-Free Probabilistic Deep State-Space Models
Look, Andreas, Kandemir, Melih, Rakitsch, Barbara, Peters, Jan
Many real-world dynamical systems can be described as State-Space Models (SSMs). In this formulation, each observation is emitted by a latent state, which follows first-order Markovian dynamics. A Probabilistic Deep SSM (ProDSSM) generalizes this framework to dynamical systems of unknown parametric form, where the transition and emission models are described by neural networks with uncertain weights. In this work, we propose the first deterministic inference algorithm for models of this type. Our framework allows efficient approximations for training and testing. We demonstrate in our experiments that our new method can be employed for a variety of tasks and enjoys a superior balance between predictive performance and computational budget.
Optimal scheduling of entropy regulariser for continuous-time linear-quadratic reinforcement learning
Szpruch, Lukasz, Treetanthiploet, Tanut, Zhang, Yufei
This work uses the entropy-regularised relaxed stochastic control perspective as a principled framework for designing reinforcement learning (RL) algorithms. Herein agent interacts with the environment by generating noisy controls distributed according to the optimal relaxed policy. The noisy policies on the one hand, explore the space and hence facilitate learning but, on the other hand, introduce bias by assigning a positive probability to non-optimal actions. This exploration-exploitation trade-off is determined by the strength of entropy regularisation. We study algorithms resulting from two entropy regularisation formulations: the exploratory control approach, where entropy is added to the cost objective, and the proximal policy update approach, where entropy penalises policy divergence between consecutive episodes. We focus on the finite horizon continuous-time linear-quadratic (LQ) RL problem, where a linear dynamics with unknown drift coefficients is controlled subject to quadratic costs. In this setting, both algorithms yield a Gaussian relaxed policy. We quantify the precise difference between the value functions of a Gaussian policy and its noisy evaluation and show that the execution noise must be independent across time. By tuning the frequency of sampling from relaxed policies and the parameter governing the strength of entropy regularisation, we prove that the regret, for both learning algorithms, is of the order $\mathcal{O}(\sqrt{N}) $ (up to a logarithmic factor) over $N$ episodes, matching the best known result from the literature.
A Bayesian approach to breaking things: efficiently predicting and repairing failure modes via sampling
From power grids to transportation and logistics systems, autonomous systems play a central, and often safety-critical, role in modern life. Even as these systems grow more complex and ubiquitous, we have already observed failures in autonomous systems like autonomous vehicles and power networks resulting in the loss of human life [1]. Given this context, it is important that we be able to verify the safety of autonomous systems prior to deployment; for instance, by understanding the different ways in which a system might fail and proposing repair strategies. Human designers often use their knowledge of likely failure modes to guide the design process; indeed, systematically assessing the risks of different failures and developing repair strategies is an important part of the systems engineering process [2]. However, as autonomous systems grow more complex, it becomes increasingly difficult for human engineers to manually predict likely failures. In this paper, we propose an automated framework for predicting, and then repairing, failure modes in complex autonomous systems. Our effort builds on a large body of work on testing and verification of autonomous systems, many of which focus on identifying failure modes or adversarial examples [3, 4, 5, 6, 7, 8], but we identify two major gaps in the state of the art. First, many existing methods [4, 5, 9, 7] use techniques like gradient descent to search locally for failure modes; however, in practice we are more interested in characterizing the distribution of potential failures, which requires a global perspective. Some methods exist that address this issue by taking a probabilistic approach to sample from an (unknown) distribution of failure modes [6, 10].
Heuristic Satisficing Inferential Decision Making in Human and Robot Active Perception
Chen, Yucheng, Zhu, Pingping, Alers, Anthony, Egner, Tobias, Sommer, Marc A., Ferrari, Silvia
Inferential decision-making algorithms typically assume that an underlying probabilistic model of decision alternatives and outcomes may be learned a priori or online. Furthermore, when applied to robots in real-world settings they often perform unsatisfactorily or fail to accomplish the necessary tasks because this assumption is violated and/or they experience unanticipated external pressures and constraints. Cognitive studies presented in this and other papers show that humans cope with complex and unknown settings by modulating between near-optimal and satisficing solutions, including heuristics, by leveraging information value of available environmental cues that are possibly redundant. Using the benchmark inferential decision problem known as ``treasure hunt", this paper develops a general approach for investigating and modeling active perception solutions under pressure. By simulating treasure hunt problems in virtual worlds, our approach learns generalizable strategies from high performers that, when applied to robots, allow them to modulate between optimal and heuristic solutions on the basis of external pressures and probabilistic models, if and when available. The result is a suite of active perception algorithms for camera-equipped robots that outperform treasure-hunt solutions obtained via cell decomposition, information roadmap, and information potential algorithms, in both high-fidelity numerical simulations and physical experiments. The effectiveness of the new active perception strategies is demonstrated under a broad range of unanticipated conditions that cause existing algorithms to fail to complete the search for treasures, such as unmodelled time constraints, resource constraints, and adverse weather (fog).
Exploiting Noise as a Resource for Computation and Learning in Spiking Neural Networks
Ma, Gehua, Yan, Rui, Tang, Huajin
$\textbf{Formal version available at}$ https://cell.com/patterns/fulltext/S2666-3899(23)00200-3 Networks of spiking neurons underpin the extraordinary information-processing capabilities of the brain and have become pillar models in neuromorphic artificial intelligence. Despite extensive research on spiking neural networks (SNNs), most studies are established on deterministic models, overlooking the inherent non-deterministic, noisy nature of neural computations. This study introduces the noisy spiking neural network (NSNN) and the noise-driven learning rule (NDL) by incorporating noisy neuronal dynamics to exploit the computational advantages of noisy neural processing. NSNN provides a theoretical framework that yields scalable, flexible, and reliable computation. We demonstrate that NSNN leads to spiking neural models with competitive performance, improved robustness against challenging perturbations than deterministic SNNs, and better reproducing probabilistic computations in neural coding. This study offers a powerful and easy-to-use tool for machine learning, neuromorphic intelligence practitioners, and computational neuroscience researchers.
Physics-informed Bayesian inference of external potentials in classical density-functional theory
Malpica-Morales, Antonio, Yatsyshin, Peter, Duran-Olivencia, Miguel A., Kalliadasis, Serafim
The swift progression of machine learning (ML) has not gone unnoticed in the realm of statistical mechanics. ML techniques have attracted attention by the classical density-functional theory (DFT) community, as they enable discovery of free-energy functionals to determine the equilibrium-density profile of a many-particle system. Within DFT, the external potential accounts for the interaction of the many-particle system with an external field, thus, affecting the density distribution. In this context, we introduce a statistical-learning framework to infer the external potential exerted on a many-particle system. We combine a Bayesian inference approach with the classical DFT apparatus to reconstruct the external potential, yielding a probabilistic description of the external potential functional form with inherent uncertainty quantification. Our framework is exemplified with a grand-canonical one-dimensional particle ensemble with excluded volume interactions in a confined geometry. The required training dataset is generated using a Monte Carlo (MC) simulation where the external potential is applied to the grand-canonical ensemble. The resulting particle coordinates from the MC simulation are fed into the learning framework to uncover the external potential. This eventually allows us to compute the equilibrium density profile of the system by using the tools of DFT. Our approach benchmarks the inferred density against the exact one calculated through the DFT formulation with the true external potential. The proposed Bayesian procedure accurately infers the external potential and the density profile. We also highlight the external-potential uncertainty quantification conditioned on the amount of available simulated data. The seemingly simple case study introduced in this work might serve as a prototype for studying a wide variety of applications, including adsorption and capillarity.
Learning nonparametric DAGs with incremental information via high-order HSIC
Score-based methods for learning Bayesain networks(BN) aim to maximizing the global score functions. However, if local variables have direct and indirect dependence simultaneously, the global optimization on score functions misses edges between variables with indirect dependent relationship, of which scores are smaller than those with direct dependent relationship. In this paper, we present an identifiability condition based on a determined subset of parents to identify the underlying DAG. By the identifiability condition, we develop a two-phase algorithm namely optimal-tuning (OT) algorithm to locally amend the global optimization. In the optimal phase, an optimization problem based on first-order Hilbert-Schmidt independence criterion (HSIC) gives an estimated skeleton as the initial determined parents subset. In the tuning phase, the skeleton is locally tuned by deletion, addition and DAG-formalization strategies using the theoretically proved incremental properties of high-order HSIC. Numerical experiments for different synthetic datasets and real-world datasets show that the OT algorithm outperforms existing methods. Especially in Sigmoid Mix model with the size of the graph being ${\rm\bf d=40}$, the structure intervention distance (SID) of the OT algorithm is 329.7 smaller than the one obtained by CAM, which indicates that the graph estimated by the OT algorithm misses fewer edges compared with CAM.Source code of the OT algorithm is available at https://github.com/YafeiannWang/optimal-tune-algorithm.
Scalable Bayesian optimization with high-dimensional outputs using randomized prior networks
Bhouri, Mohamed Aziz, Joly, Michael, Yu, Robert, Sarkar, Soumalya, Perdikaris, Paris
Several fundamental problems in science and engineering consist of global optimization tasks involving unknown high-dimensional (black-box) functions that map a set of controllable variables to the outcomes of an expensive experiment. Bayesian Optimization (BO) techniques are known to be effective in tackling global optimization problems using a relatively small number objective function evaluations, but their performance suffers when dealing with high-dimensional outputs. To overcome the major challenge of dimensionality, here we propose a deep learning framework for BO and sequential decision making based on bootstrapped ensembles of neural architectures with randomized priors. Using appropriate architecture choices, we show that the proposed framework can approximate functional relationships between design variables and quantities of interest, even in cases where the latter take values in high-dimensional vector spaces or even infinite-dimensional function spaces. In the context of BO, we augmented the proposed probabilistic surrogates with re-parameterized Monte Carlo approximations of multiple-point (parallel) acquisition functions, as well as methodological extensions for accommodating black-box constraints and multi-fidelity information sources. We test the proposed framework against state-of-the-art methods for BO and demonstrate superior performance across several challenging tasks with high-dimensional outputs, including a constrained multi-fidelity optimization task involving shape optimization of rotor blades in turbo-machinery.
On the Local Quadratic Stability of T-S Fuzzy Systems in the Vicinity of the Origin
The main goal of this paper is to introduce new local stability conditions for continuous-time Takagi-Sugeno (T-S) fuzzy systems. These stability conditions are based on linear matrix inequalities (LMIs) in combination with quadratic Lyapunov functions. Moreover, they integrate information on the membership functions at the origin and effectively leverage the linear structure of the underlying nonlinear system in the vicinity of the origin. As a result, the proposed conditions are proved to be less conservative compared to existing methods using fuzzy Lyapunov functions in the literature. Moreover, we establish that the proposed methods offer necessary and sufficient conditions for the local exponential stability of T-S fuzzy systems. The paper also includes discussions on the inherent limitations associated with fuzzy Lyapunov approaches. To demonstrate the theoretical results, we provide comprehensive examples that elucidate the core concepts and validate the efficacy of the proposed conditions.
Imprecise Bayesian Neural Networks
Caprio, Michele, Dutta, Souradeep, Jang, Kuk Jin, Lin, Vivian, Ivanov, Radoslav, Sokolsky, Oleg, Lee, Insup
Uncertainty quantification and robustness to distribution shifts are important goals in machine learning and artificial intelligence. Although Bayesian Neural Networks (BNNs) allow for uncertainty in the predictions to be assessed, different sources of uncertainty are indistinguishable. We present Imprecise Bayesian Neural Networks (IBNNs); they generalize and overcome some of the drawbacks of standard BNNs. These latter are trained using a single prior and likelihood distributions, whereas IBNNs are trained using credal prior and likelihood sets. They allow to distinguish between aleatoric and epistemic uncertainties, and to quantify them. In addition, IBNNs are more robust than BNNs to prior and likelihood misspecification, and to distribution shift. They can also be used to compute sets of outcomes that enjoy probabilistic guarantees. We apply IBNNs to two case studies. One, for motion prediction in autonomous driving scenarios, and two, to model blood glucose and insulin dynamics for artificial pancreas control. We show that IBNNs performs better when compared to an ensemble of BNNs benchmark.