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826篇论文匹配“Optimization and Learning under Uncertainty”
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Sriyash Poddar, Yanming Wan, Hamish Ivison, Abhishek Gupta, Natasha Jaques

Reinforcement Learning from Human Feedback (RLHF) is a powerful paradigm for aligning foundation models to human values and preferences. However, current RLHF techniques cannot account for the naturally occurring differences in individual human preferences across a diverse population. When these differences arise, traditional RLHF frameworks simply average over them, leading to inaccurate rewards and poor performance for individual subgroups. To address the need for pluralistic alignment, we develop a class of multimodal RLHF methods. Our proposed techniques are based on a latent variable formulation - inferring a novel user-specific latent and learning reward models and policies conditioned on this latent without additional user-specific data. While conceptually simple, we show that in practice, this reward modeling requires careful algorithmic considerations around model architecture and reward scaling. To empirically validate our proposed technique, we first show that it can provide a way to combat underspecification in simulated control problems, inferring and optimizing user-specific reward functions. Next, we conduct experiments on pluralistic language datasets representing diverse user preferences and demonstrate improved reward function accuracy. We additionally show the benefits of this probabilistic framework in terms of measuring uncertainty, and actively learning user preferences. This work enables learning from diverse populations of users with divergent preferences, an important challenge that naturally occurs in problems from robot learning to foundation model alignment.

Deep Learning · Robustness

Daksh Mittal, Yuanzhe Ma, Shalmali Joshi, Hongseok Namkoong

Datasets often suffer severe selection bias; clinical labels are only available on patients for whom doctors ordered medical exams. To assess model performance outside the support of available data, we present a computational framework for adaptive labeling, providing cost-efficient model evaluations under severe distribution shifts. We formulate the problem as a Markov Decision Process over states defined by posterior beliefs on model performance. Each batch of new labels incurs a “state transition” to sharper beliefs, and we choose batches to minimize uncertainty on model performance at the end of the label collection process. Instead of relying on high-variance REINFORCE policy gradient estimators that do not scale, our adaptive labeling policy is optimized using path-wise policy gradients computed by auto-differentiating through simulated roll-outs. Our framework is agnostic to different uncertainty quantification approaches and highlights the virtue of planning in adaptive labeling. On synthetic and real datasets, we empirically demonstrate even a one-step lookahead policy substantially outperforms active learning-inspired heuristics.

Deep Learning · Algorithms

Kaizheng Wang, Fabio Cuzzolin, Shireen Kudukkil Manchingal -, Keivan Shariatmadar, David Moens, Hans Hallez

This paper introduces an innovative approach to classification called Credal Deep Ensembles (CreDEs), namely, ensembles of novel Credal-Set Neural Networks (CreNets). CreNets are trained to predict a lower and an upper probability bound for each class, which, in turn, determine a convex set of probabilities (credal set) on the class set. The training employs a loss inspired by distributionally robust optimization which simulates the potential divergence of the test distribution from the training distribution, in such a way that the width of the predicted probability interval reflects the epistemic uncertainty about the future data distribution. Ensembles can be constructed by training multiple CreNets, each associated with a different random seed, and averaging the outputted intervals. Extensive experiments are conducted on various out-of-distributions (OOD) detection benchmarks (CIFAR10/100 vs SVHN/Tiny-ImageNet, CIFAR10 vs CIFAR10-C, ImageNet vs ImageNet-O) and using different network architectures (ResNet50, VGG16, and ViT Base). Compared to Deep Ensemble baselines, CreDEs demonstrate higher test accuracy, lower expected calibration error, and significantly improved epistemic uncertainty estimation.

Optimization · Optimization and Learning under Uncertainty

Ziyad Benomar, Dorian Baudry, Vianney Perchet

Prophet inequalities are fundamental optimal stopping problems, where a decision-maker observes sequentially items with values sampled independently from known distributions, and must decide at each new observation to either stop and gain the current value or reject it irrevocably and move to the next step. This model is often too pessimistic and does not adequately represent real-world online selection processes. Potentially, rejectesd items can be revisited and a fraction of their value can be recovered. To analyze this problem, we consider general decay functions $D_1,D_2,\ldots$, quantifying the value to be recovered from a rejected item, depending on how far it has been observed in the past. We analyze how lookback improves, or not, the competitive ratio in prophet inequalities in different order models. We show that, under mild monotonicity assumptions on the decay functions, the problem can be reduced to the case where all the decay functions are equal to the same function $x \mapsto \gamma x$, where $\gamma = \inf_{x>0} \inf_{j \geq 1} D_j(x)/x$. Consequently, we focus on this setting and refine the analyses of the competitive ratios, with upper and lower bounds expressed as increasing functions of $\gamma$.

Online Learning

Wenhao Yang, Yibo Wang, Peng Zhao, Lijun Zhang

To address the uncertainty in function types, recent progress in online convex optimization (OCO) has spurred the development of universal algorithms that simultaneously attain minimax rates for multiple types of convex functions. However, for a $T$-round online problem, state-of-the-art methods typically conduct $O(\log T)$ projections onto the domain in each round, a process potentially time-consuming with complicated feasible sets. In this paper, inspired by the black-box reduction of Cutkosky and Orabona [2018], we employ a surrogate loss defined over simpler domains to develop universal OCO algorithms that only require $1$ projection. Embracing the framework of prediction with expert advice, we maintain a set of experts for each type of functions and aggregate their predictions via a meta-algorithm. The crux of our approach lies in a uniquely designed expert-loss for strongly convex functions, stemming from an innovative decomposition of the regret into the meta-regret and the expert-regret. Our analysis sheds new light on the surrogate loss, facilitating a rigorous examination of the discrepancy between the regret of the original loss and that of the surrogate loss, and carefully controlling meta-regret under the strong convexity condition. With only $1$ projection per round, we establish optimal regret bounds for general convex, exponentially concave, and strongly convex functions simultaneously. Furthermore, we enhance the expert-loss to exploit the smoothness property, and demonstrate that our algorithm can attain small-loss regret for multiple types of convex and smooth functions.

Reinforcement Learning · Multi-agent

Dongsu Lee, Minhae Kwon

Understanding cognitive processes in multi-agent interactions is a primary goal in cognitive science. It can guide the direction of artificial intelligence (AI) research toward social decision-making in multi-agent systems, which includes uncertainty from character heterogeneity. In this paper, we introduce *episodic future thinking (EFT) mechanism* for a reinforcement learning (RL) agent, inspired by the cognitive processes observed in animals. To enable future thinking functionality, we first develop a *multi-character policy* that captures diverse characters with an ensemble of heterogeneous policies. The *character* of an agent is defined as a different weight combination on reward components, representing distinct behavioral preferences. The future thinking agent collects observation-action trajectories of the target agents and leverages the pre-trained multi-character policy to infer their characters. Once the character is inferred, the agent predicts the upcoming actions of target agents and simulates the potential future scenario. This capability allows the agent to adaptively select the optimal action, considering the predicted future scenario in multi-agent scenarios. To evaluate the proposed mechanism, we consider the multi-agent autonomous driving scenario in which autonomous vehicles with different driving traits are on the road. Simulation results demonstrate that the EFT mechanism with accurate character inference leads to a higher reward than existing multi-agent solutions. We also confirm that the effect of reward improvement remains valid across societies with different levels of character diversity.

Reinforcement Learning · Batch Offline

Haobo Zhang, Xiyue Peng, Honghao Wei, Xin Liu

Offline safe reinforcement learning (RL) aims to find an optimal policy using a pre-collected dataset when data collection is impractical or risky. We propose a novel linear programming (LP) based primal-dual algorithm for convex MDPs that incorporates ``uncertainty'' parameters to improve data efficiency while requiring only partial data coverage assumption. Our theoretical results achieve a sample complexity of $\mathcal{O}(1/(1-\gamma)\sqrt{n})$ under general function approximation, improving the current state-of-the-art by a factor of $1/(1-\gamma)$, where $n$ is the number of data samples in an offline dataset, and $\gamma$ is the discount factor. The numerical experiments validate our theoretical findings, demonstrating the practical efficacy of our approach in achieving improved safety and learning efficiency in safe offline settings.

Optimization · Optimization and Learning under Uncertainty

Theodore Brown, Alexandru Cioba, Ilija Bogunovic

Bayesian optimisation (BO) is a powerful framework for global optimisation of costly functions, using predictions from Gaussian process models (GPs). In this work, we apply BO to functions that exhibit invariance to a known group of transformations. We show that vanilla and constrained BO algorithms are inefficient when optimising such invariant objectives, and provide a method for incorporating group invariances into the kernel of the GP to produce invariance-aware algorithms that achieve significant improvements in sample efficiency. We derive a bound on the maximum information gain of these invariant kernels, and provide novel upper and lower bounds on the number of observations required for invariance-aware BO algorithms to achieve $\epsilon$-optimality. We demonstrate our method's improved performance on a range of synthetic invariant and quasi-invariant functions. We also apply our method in the case where only some of the invariance is incorporated into the kernel, and find that these kernels achieve similar gains in sample efficiency at significantly reduced computational cost. Finally, we use invariant BO to design a current drive system for a nuclear fusion reactor, finding a high-performance solution where non-invariant methods failed.

Causality

Burak Varıcı, Dmitriy Katz, Dennis Wei, Prasanna Sattigeri, Ali Tajer

Causal interactions among a group of variables are often modeled by a single causal graph. In some domains, however, these interactions are best described by multiple co-existing causal graphs, e.g., in dynamical systems or genomics. This paper addresses the hitherto unknown role of interventions in learning causal interactions among variables governed by a mixture of causal systems, each modeled by one directed acyclic graph (DAG). Causal discovery from mixtures is fundamentally more challenging than single-DAG causal discovery. Two major difficulties stem from (i) an inherent uncertainty about the skeletons of the component DAGs that constitute the mixture and (ii) possibly cyclic relationships across these component DAGs. This paper addresses these challenges and aims to identify edges that exist in at least one component DAG of the mixture, referred to as the *true* edges. First, it establishes matching necessary and sufficient conditions on the size of interventions required to identify the true edges. Next, guided by the necessity results, an adaptive algorithm is designed that learns all true edges using ${\cal O}(n^2)$ interventions, where $n$ is the number of nodes. Remarkably, the size of the interventions is optimal if the underlying mixture model does not contain cycles across its components. More generally, the gap between the intervention size used by the algorithm and the optimal size is quantified. It is shown to be bounded by the *cyclic complexity number* of the mixture model, defined as the size of the minimal intervention that can break the cycles in the mixture, which is upper bounded by the number of cycles among the ancestors of a node.

Theory · Reinforcement Learning and Planning

Bianca Marin Moreno, Margaux Brégère, Pierre Gaillard, Nadia Oudjane

We explore online learning in episodic loop-free Markov decision processes on non-stationary environments (changing losses and probability transitions). Our focus is on the Concave Utility Reinforcement Learning problem (CURL), an extension of classical RL for handling convex performance criteria in state-action distributions induced by agent policies. While various machine learning problems can be written as CURL, its non-linearity invalidates traditional Bellman equations. Despite recent solutions to classical CURL, none address non-stationary MDPs. This paper introduces MetaCURL, the first CURL algorithm for non-stationary MDPs. It employs a meta-algorithm running multiple black-box algorithms instances over different intervals, aggregating outputs via a sleeping expert framework. The key hurdle is partial information due to MDP uncertainty. Under partial information on the probability transitions (uncertainty and non-stationarity coming only from external noise, independent of agent state-action pairs), we achieve optimal dynamic regret without prior knowledge of MDP changes. Unlike approaches for RL, MetaCURL handles full adversarial losses, not just stochastic ones. We believe our approach for managing non-stationarity with experts can be of interest to the RL community.

Pierre Clavier, Laixi Shi, Erwan Le Pennec, Eric Mazumdar, Adam Wierman, Matthieu Geist

To address the challenges of sim-to-real gap and sample efficiency in reinforcement learning (RL), this work studies distributionally robust Markov decision processes (RMDPs) --- optimize the worst-case performance when the deployed environment is within an uncertainty set around some nominal MDP. Despite recent efforts, the sample complexity of RMDPs has remained largely undetermined. While the statistical implications of distributional robustness in RL have been explored in some specific cases, the generalizability of the existing findings remains unclear, especially in comparison to standard RL. Assuming access to a generative model that samples from the nominal MDP, we examine the sample complexity of RMDPs using a class of generalized $L_p$ norms as the 'distance' function for the uncertainty set, under two commonly adopted $sa$-rectangular and $s$-rectangular conditions. Our results imply that RMDPs can be more sample-efficient to solve than standard MDPs using generalized $L_p$ norms in both $sa$- and $s$-rectangular cases, potentially inspiring more empirical research. We provide a near-optimal upper bound and a matching minimax lower bound for the $sa$-rectangular scenarios. For $s$-rectangular cases, we improve the state-of-the-art upper bound and also derive a lower bound using $L_\infty$ norm that verifies the tightness.

Deep Learning · Robustness

Taejong Joo, Diego Klabjan

Self-training often falls short under distribution shifts due to an increased discrepancy between prediction confidence and actual accuracy. This typically necessitates computationally demanding methods such as neighborhood or ensemble-based label corrections. Drawing inspiration from insights on early learning regularization, we develop a principled method to improve self-training under distribution shifts based on temporal consistency. Specifically, we build an uncertainty-aware temporal ensemble with a simple relative thresholding. Then, this ensemble smooths noisy pseudo labels to promote selective temporal consistency. We show that our temporal ensemble is asymptotically correct and our label smoothing technique can reduce the optimality gap of self-training. Our extensive experiments validate that our approach consistently improves self-training performances by 8% to 16% across diverse distribution shift scenarios without a computational overhead. Besides, our method exhibits attractive properties, such as improved calibration performance and robustness to different hyperparameter choices.

Optimization · Optimization and Learning under Uncertainty

Michael Huang, Vishal Gupta

We propose a novel family of decision-aware surrogate losses, called Perturbation Gradient (PG) losses, for the predict-then-optimize framework. These losses directly approximate the downstream decision loss and can be optimized using off-the-shelf gradient-based methods. Importantly, unlike existing surrogate losses, the approximation error of our PG losses vanishes as the number of samples grows. This implies that optimizing our surrogate loss yields a best-in-class policy asymptotically, even in misspecified settings. This is the first such result in misspecified settings and we provide numerical evidence confirming our PG losses substantively outperform existing proposals when the underlying model is misspecified and the noise is not centrally symmetric. Insofar as misspecification is commonplace in practice -- especially when we might prefer a simpler, more interpretable model -- PG losses offer a novel, theoretically justified, method for computationally tractable decision-aware learning.

Fairness

Ahmad-Reza Ehyaei, Golnoosh Farnadi, Samira Samadi

In recent years, Wasserstein Distributionally Robust Optimization (DRO) has garnered substantial interest for its efficacy in data-driven decision-making under distributional uncertainty. However, limited research has explored the application of DRO to address individual fairness concerns, particularly when considering causal structures and discrete sensitive attributes in learning problems.To address this gap, we first formulate the DRO problem from the perspectives of causality and individual fairness. We then present the DRO dual formulation as an efficient tool to convert the main problem into a more tractable and computationally efficient form. Next, we characterize the closed form of the approximate worst-case loss quantity as a regularizer, eliminating the max-step in the Min-Max DRO problem. We further estimate the regularizer in more general cases and explore the relationship between DRO and classical robust optimization. Finally, by removing the assumption of a known structural causal model, we provide finite sample error bounds when designing DRO with empirical distributions and estimated causal structures to ensure efficiency and robust learning.

Theory · Game Theory

Antoine Scheid, Aymeric Capitaine, Etienne Boursier, Eric Moulines, Michael Jordan, Alain Durmus

In Economics, the concept of externality refers to any indirect effect resulting from an interaction between players and affecting a third party without compensation. Most of the models within which externality has been studied assume that agents have perfect knowledge of their environment and preferences. This is a major hindrance to the practical implementation of many proposed solutions. To adress this issue, we consider a two-players bandit game setting where the actions of one of the player affect the other one. Building upon this setup, we extend the Coase theorem [Coase, 2013], which suggests that the optimal approach for maximizing the social welfare in the presence of externality is to establish property rights, i.e., enabling transfers and bargaining between the players. Nonetheless, this fundamental result relies on the assumption that bargainers possess perfect knowledge of the underlying game. We first demonstrate that in the absence of property rights in the considered online scenario, the social welfare breaks down. We then provide a policy for the players, which allows them to learn a bargaining strategy which maximizes the total welfare, recovering the Coase theorem under uncertainty.

Probabilistic Methods · Bayesian Models and Methods

David Smerkous, Qinxun Bai, Fuxin Li

Particle-based Bayesian deep learning often requires a similarity metric to compare two networks. However, naive similarity metrics lack permutation invariance and are inappropriate for comparing networks. Centered Kernel Alignment (CKA) on feature kernels has been proposed to compare deep networks but has not been used as an optimization objective in Bayesian deep learning. In this paper, we explore the use of CKA in Bayesian deep learning to generate diverse ensembles and hypernetworks that output a network posterior. Noting that CKA projects kernels onto a unit hypersphere and that directly optimizing the CKA objective leads to diminishing gradients when two networks are very similar. We propose adopting the approach of hyperspherical energy (HE) on top of CKA kernels to address this drawback and improve training stability. Additionally, by leveraging CKA-based feature kernels, we derive feature repulsive terms applied to synthetically generated outlier examples. Experiments on both diverse ensembles and hypernetworks show that our approach significantly outperforms baselines in terms of uncertainty quantification in both synthetic and realistic outlier detection tasks.

Optimization · Optimization and Learning under Uncertainty

Matteo Zecchin, Osvaldo Simeone

Adaptive Risk Control (ARC) is an online calibration strategy based on set prediction that offers worst-case deterministic long-term risk control, as well as statistical marginal coverage guarantees. ARC adjusts the size of the prediction set by varying a single scalar threshold based on feedback from past decisions. In this work, we introduce Localized Adaptive Risk Control (L-ARC), an online calibration scheme that targets statistical localized risk guarantees ranging from conditional risk to marginal risk, while preserving the worst-case performance of ARC. L-ARC updates a threshold function within a reproducing kernel Hilbert space (RKHS), with the kernel determining the level of localization of the statistical risk guarantee. The theoretical results highlight a trade-off between localization of the statistical risk and convergence speed to the long-term risk target. Thanks to localization, L-ARC is demonstrated via experiments to produce prediction sets with risk guarantees across different data subpopulations, significantly improving the fairness of the calibrated model for tasks such as image segmentation and beam selection in wireless networks.

Optimization · Optimization and Learning under Uncertainty

Siyuan Zhang, Linbo Xie

Modern deep learning models often exhibit overconfident predictions, inadequately capturing uncertainty. During model optimization, the expected calibration error tends to overfit earlier than classification accuracy, indicating distinct optimization objectives for classification error and calibration error. To ensure consistent optimization of both model accuracy and model calibration, we propose a novel method incorporating a probability-dependent gradient decay coefficient into loss function. This coefficient exhibits a strong correlation with the overall confidence level. To maintain model calibration during optimization, we utilize a proportional-integral-derivative (PID) controller to dynamically adjust this gradient decay rate, where the adjustment relies on the proposed relative calibration error feedback in each epoch, thereby preventing the model from exhibiting over-confidence or under-confidence. Within the PID control system framework, the proposed relative calibration error serves as the control system output, providing an indication of the overall confidence level, while the gradient decay rate functions as the controlled variable. Moreover, recognizing the impact of gradient amplitude of adaptive decay rates, we implement an adaptive learning rate mechanism for gradient compensation to prevent inadequate learning of over-small or over-large gradient. Empirical experiments validate the efficacy of our PID-based adaptive gradient decay rate approach, ensuring consistent optimization of model calibration and model accuracy.

Optimization · Optimization and Learning under Uncertainty

Alex Elenter, Spyros Angelopoulos, Christoph Dürr, Yanni LEFKI

The study of online algorithms with machine-learned predictions has gained considerable prominence in recent years. One of the common objectives in the design and analysis of such algorithms is to attain (Pareto) optimal tradeoffs between the {\em consistency} of the algorithm, i.e., its performance assuming perfect predictions, and its {\em robustness}, i.e., the performance of the algorithm under adversarial predictions. In this work, we demonstrate that this optimization criterion can be extremely brittle, in that the performance of Pareto-optimal algorithms may degrade dramatically even in the presence of imperceptive prediction error. To remedy this drawback, we propose a new framework in which the smoothness in the performance of the algorithm is enforced by means of a {\em user-specified profile}. This allows us to regulate the performance of the algorithm as a function of the prediction error, while simultaneouslymaintaining the analytical notion of consistency/robustness tradeoffs, adapted to the profile setting. We apply this new approach to a well-studied online problem, namely the {\em one-way trading} problem. For this problem, we further address another limitation of the state-of-the-art Pareto-optimal algorithms, namely the fact that they are tailored to worst-case, and extremely pessimistic inputs. We propose a new Pareto-optimal algorithm that leverages any deviation from the worst-case input to its benefit, and introduce a new metric that allows us to compare any two Pareto-optimal algorithms via a {\em dominance} relation.

Optimization · Optimization and Learning under Uncertainty

Jose Pablo Folch, Calvin Tsay, Robert Lee, Behrang Shafei, Weronika Ormaniec, Andreas Krause, Mark van der Wilk, Ruth Misener, Mojmir Mutny

Bayesian optimization is a methodology to optimize black-box functions. Traditionally, it focuses on the setting where you can arbitrarily query the search space. However, many real-life problems do not offer this flexibility; in particular, the search space of the next query may depend on previous ones. Example challenges arise in the physical sciences in the form of local movement constraints, required monotonicity in certain variables, and transitions influencing the accuracy of measurements. Altogether, such *transition constraints* necessitate a form of planning. This work extends classical Bayesian optimization via the framework of Markov Decision Processes. We iteratively solve a tractable linearization of our utility function using reinforcement learning to obtain a policy that plans ahead for the entire horizon. This is a parallel to the optimization of an *acquisition function in policy space*. The resulting policy is potentially history-dependent and non-Markovian. We showcase applications in chemical reactor optimization, informative path planning, machine calibration, and other synthetic examples.