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SPO: Sequential Monte Carlo Policy Optimisation

Neural Information Processing Systems

Leveraging planning during learning and decision-making is central to the longterm development of intelligent agents. Recent works have successfully combined tree-based search methods and self-play learning mechanisms to this end. However, these methods typically face scaling challenges due to the sequential nature of their search. While practical engineering solutions can partly overcome this, they often result in a negative impact on performance. In this paper, we introduce SPO: Sequential Monte Carlo Policy Optimisation, a model-based reinforcement learning algorithm grounded within the Expectation Maximisation (EM) framework. We show that SPO provides robust policy improvement and efficient scaling properties. The sample-based search makes it directly applicable to both discrete and continuous action spaces without modifications. We demonstrate statistically significant improvements in performance relative to model-free and model-based baselines across both continuous and discrete environments. Furthermore, the parallel nature of SPO's search enables effective utilisation of hardware accelerators, yielding favourable scaling laws.


Learning Low-Dimensional Metrics

Neural Information Processing Systems

This paper investigates the theoretical foundations of metric learning, focused on three key questions that are not fully addressed in prior work: 1) we consider learning general low-dimensional (low-rank) metrics as well as sparse metrics; 2) we develop upper and lower (minimax) bounds on the generalization error; 3) we quantify the sample complexity of metric learning in terms of the dimension of the feature space and the dimension/rank of the underlying metric; 4) we also bound the accuracy of the learned metric relative to the underlying true generative metric. All the results involve novel mathematical approaches to the metric learning problem, and also shed new light on the special case of ordinal embedding (aka non-metric multidimensional scaling).


Reviews: Is Q-Learning Provably Efficient?

Neural Information Processing Systems

This paper studies the problem of efficient exploration in finite episodic MDPs. They present a variant of optimistic initialization tuned learning rates for Q-learning that recover a UCB-style algorithm. The main contribution of this work is a polynomial regret bound for perhaps one of the most iconic "model-free" algorithms. There are several things to like about this paper: - Q-learning is perhaps the classic intro to RL algorithms, so it's nice to see that we can recover sample efficient guarantees for a variant of this algorithm. The computational time is also particularly appealing compared to existing model-free algorithms with sqrt{T} *expected* (Bayesian) regret (such as RLSVI), which have much higher computational and memory requirements.


Reinforcement Learning for Solving the Vehicle Routing Problem

Neural Information Processing Systems

We present an end-to-end framework for solving the Vehicle Routing Problem (VRP) using reinforcement learning. In this approach, we train a single policy model that finds near-optimal solutions for a broad range of problem instances of similar size, only by observing the reward signals and following feasibility rules. We consider a parameterized stochastic policy, and by applying a policy gradient algorithm to optimize its parameters, the trained model produces the solution as a sequence of consecutive actions in real time, without the need to re-train for every new problem instance. On capacitated VRP, our approach outperforms classical heuristics and Google's OR-Tools on medium-sized instances in solution quality with comparable computation time (after training). We demonstrate how our approach can handle problems with split delivery and explore the effect of such deliveries on the solution quality. Our proposed framework can be applied to other variants of the VRP such as the stochastic VRP, and has the potential to be applied more generally to combinatorial optimization problems.


Advancing Video Anomaly Detection: A Concise Review and a New Dataset Arjun Raj

Neural Information Processing Systems

Video Anomaly Detection (VAD) finds widespread applications in security surveillance, traffic monitoring, industrial monitoring, and healthcare. Despite extensive research efforts, there remains a lack of concise reviews that provide insightful guidance for researchers. Such reviews would serve as quick references to grasp current challenges, research trends, and future directions.


A survey and benchmark of high-dimensional Bayesian optimization of discrete sequences Richard Michael University of Copenhagen University of Copenhagen Simon Bartels

Neural Information Processing Systems

Optimizing discrete black box functions is key in several domains, e.g. protein engineering and drug design. Due to the lack of gradient information and the need for sample efficiency, Bayesian optimization is an ideal candidate for these tasks. Several methods for high-dimensional continuous and categorical Bayesian optimization have been proposed recently. However, our survey of the field reveals highly heterogeneous experimental set-ups across methods and technical barriers for the replicability and application of published algorithms to real-world tasks. To address these issues, we develop a unified framework to test a vast array of high-dimensional Bayesian optimization methods and a collection of standardized black box functions representing real-world application domains in chemistry and biology. These two components of the benchmark are each supported by flexible, scalable, and easily extendable software libraries (poli and poli-baselines), allowing practitioners to readily incorporate new optimization objectives or discrete optimizers.


OT4P: Unlocking Effective Orthogonal Group Path for Permutation Relaxation

Neural Information Processing Systems

Optimization over permutations is typically an NP-hard problem that arises extensively in ranking, matching, tracking, etc. Birkhoff polytope-based relaxation methods have made significant advancements, particularly in penalty-free optimization and probabilistic inference. Relaxation onto the orthogonal group offers unique potential advantages such as a lower representation dimension and preservation of inner products; however, equally effective approaches remain unexplored. To bridge the gap, we present a temperature-controlled differentiable transformation that maps unconstrained vector space to the orthogonal group, where the temperature, in the limit, concentrates orthogonal matrices near permutation matrices. This transformation naturally implements a parameterization for the relaxation of permutation matrices, allowing for gradient-based optimization of problems involving permutations. Additionally, by deriving a re-parameterized gradient estimator, this transformation also provides efficient stochastic optimization over the latent permutations. Extensive experiments involving the optimization over permutation matrices validate the effectiveness of the proposed method.



D4Explainer: In-Distribution GNN Explanations via Discrete Denoising Diffusion

Neural Information Processing Systems

The widespread deployment of Graph Neural Networks (GNNs) sparks significant interest in their explainability, which plays a vital role in model auditing and ensuring trustworthy graph learning. The objective of GNN explainability is to discern the underlying graph structures that have the most significant impact on model predictions. Ensuring that explanations generated are reliable necessitates consideration of the in-distribution property, particularly due to the vulnerability of GNNs to out-of-distribution data. Unfortunately, prevailing explainability methods tend to constrain the generated explanations to the structure of the original graph, thereby downplaying the significance of the in-distribution property and resulting in explanations that lack reliability. To address these challenges, we propose D4Explainer, a novel approach that provides in-distribution GNN explanations for both counterfactual and model-level explanation scenarios. The proposed D4Explainer incorporates generative graph distribution learning into the optimization objective, which accomplishes two goals: 1) generate a collection of diverse counterfactual graphs that conform to the in-distribution property for a given instance, and 2) identify the most discriminative graph patterns that contribute to a specific class prediction, thus serving as model-level explanations. It is worth mentioning that D4Explainer is the first unified framework that combines both counterfactual and model-level explanations. Empirical evaluations conducted on synthetic and real-world datasets provide compelling evidence of the state-ofthe-art performance achieved by D4Explainer in terms of explanation accuracy, faithfulness, diversity, and robustness.


Anytime-Competitive Reinforcement Learning with Policy Prior

Neural Information Processing Systems

This paper studies the problem of Anytime-Competitive Markov Decision Process (A-CMDP). Existing works on Constrained Markov Decision Processes (CMDPs) aim to optimize the expected reward while constraining the expected cost over random dynamics, but the cost in a specific episode can still be unsatisfactorily high. In contrast, the goal of A-CMDP is to optimize the expected reward while guaranteeing a bounded cost in each round of any episode against a policy prior. We propose a new algorithm, called Anytime-Competitive Reinforcement Learning (ACRL), which provably guarantees the anytime cost constraints. The regret analysis shows the policy asymptotically matches the optimal reward achievable under the anytime competitive constraints. Experiments on the application of carbonintelligent computing verify the reward performance and cost constraint guarantee of ACRL.