FAST: Boosting Uncertainty-based Test Prioritization Methods for Neural Networks via Feature Selection

Due to the vast testing space, the increasing demand for effective and efficient testing of deep neural networks (DNNs) has led to the development of various DNN test case prioritization techniques. However, the fact that DNNs can deliver high-confidence predictions for incorrectly predicted examples, known as the over-confidence problem, causes these methods to fail to reveal high-confidence errors. To address this limitation, in this work, we propose FAST, a method that boosts existing prioritization methods through guided FeAture SelecTion. FAST is based on the insight that certain features may introduce noise that affects the model's output confidence, thereby contributing to high-confidence errors. It quantifies the importance of each feature for the model's correct predictions, and then dynamically prunes the information from the noisy features during inference to derive a new probability vector for the uncertainty estimation. With the help of FAST, the high-confidence errors and correctly classified examples become more distinguishable, resulting in higher APFD (Average Percentage of Fault Detection) values for test prioritization, and higher generalization ability for model enhancement. We conduct extensive experiments to evaluate FAST across a diverse set of model structures on multiple benchmark datasets to validate the effectiveness, efficiency, and scalability of FAST compared to the state-of-the-art prioritization techniques.

PREMAP: A Unifying PREiMage APproximation Framework for Neural Networks

Most methods for neural network verification focus on bounding the image, i.e., set of outputs for a given input set. This can be used to, for example, check the robustness of neural network predictions to bounded perturbations of an input. However, verifying properties concerning the preimage, i.e., the set of inputs satisfying an output property, requires abstractions in the input space. We present a general framework for preimage abstraction that produces under- and over-approximations of any polyhedral output set. Our framework employs cheap parameterised linear relaxations of the neural network, together with an anytime refinement procedure that iteratively partitions the input region by splitting on input features and neurons. The effectiveness of our approach relies on carefully designed heuristics and optimization objectives to achieve rapid improvements in the approximation volume. We evaluate our method on a range of tasks, demonstrating significant improvement in efficiency and scalability to high-input-dimensional image classification tasks compared to state-of-the-art techniques. Further, we showcase the application to quantitative verification and robustness analysis, presenting a sound and complete algorithm for the former and providing sound quantitative results for the latter.

FullCert: Deterministic End-to-End Certification for Training and Inference of Neural Networks

Modern machine learning models are sensitive to the manipulation of both the training data (poisoning attacks) and inference data (adversarial examples). Recognizing this issue, the community has developed many empirical defenses against both attacks and, more recently, provable certification methods against inference-time attacks. However, such guarantees are still largely lacking for training-time attacks. In this work, we present FullCert, the first end-to-end certifier with sound, deterministic bounds, which proves robustness against both training-time and inference-time attacks. We first bound all possible perturbations an adversary can make to the training data under the considered threat model. Using these constraints, we bound the perturbations' influence on the model's parameters. Finally, we bound the impact of these parameter changes on the model's prediction, resulting in joint robustness guarantees against poisoning and adversarial examples. To facilitate this novel certification paradigm, we combine our theoretical work with a new open-source library BoundFlow, which enables model training on bounded datasets. We experimentally demonstrate FullCert's feasibility on two different datasets.

Automated Design of Linear Bounding Functions for Sigmoidal Nonlinearities in Neural Networks

The ubiquity of deep learning algorithms in various applications has amplified the need for assuring their robustness against small input perturbations such as those occurring in adversarial attacks. Existing complete verification techniques offer provable guarantees for all robustness queries but struggle to scale beyond small neural networks. To overcome this computational intractability, incomplete verification methods often rely on convex relaxation to over-approximate the nonlinearities in neural networks. Progress in tighter approximations has been achieved for piecewise linear functions. However, robustness verification of neural networks for general activation functions (e.g., Sigmoid, Tanh) remains under-explored and poses new challenges. Typically, these networks are verified using convex relaxation techniques, which involve computing linear upper and lower bounds of the nonlinear activation functions. In this work, we propose a novel parameter search method to improve the quality of these linear approximations. Specifically, we show that using a simple search method, carefully adapted to the given verification problem through state-of-the-art algorithm configuration techniques, improves the average global lower bound by 25% on average over the current state of the art on several commonly used local robustness verification benchmarks.

Learning Decision Policies with Instrumental Variables through Double Machine Learning

A common issue in learning decision-making policies in data-rich settings is spurious correlations in the offline dataset, which can be caused by hidden confounders. Instrumental variable (IV) regression, which utilises a key unconfounded variable known as the instrument, is a standard technique for learning causal relationships between confounded action, outcome, and context variables. Most recent IV regression algorithms use a two-stage approach, where a deep neural network (DNN) estimator learnt in the first stage is directly plugged into the second stage, in which another DNN is used to estimate the causal effect. Naively plugging the estimator can cause heavy bias in the second stage, especially when regularisation bias is present in the first stage estimator. We propose DML-IV, a non-linear IV regression method that reduces the bias in two-stage IV regressions and effectively learns high-performing policies. We derive a novel learning objective to reduce bias and design the DML-IV algorithm following the double/debiased machine learning (DML) framework. The learnt DML-IV estimator has strong convergence rate and $O(N^{-1/2})$ suboptimality guarantees that match those when the dataset is unconfounded. DML-IV outperforms state-of-the-art IV regression methods on IV regression benchmarks and learns high-performing policies in the presence of instruments.

The Trembling-Hand Problem for LTLf Planning

Consider an agent acting to achieve its temporal goal, but with a "trembling hand". In this case, the agent may mistakenly instruct, with a certain (typically small) probability, actions that are not intended due to faults or imprecision in its action selection mechanism, thereby leading to possible goal failure. We study the trembling-hand problem in the context of reasoning about actions and planning for temporally extended goals expressed in Linear Temporal Logic on finite traces (LTLf), where we want to synthesize a strategy (aka plan) that maximizes the probability of satisfying the LTLf goal in spite of the trembling hand. We consider both deterministic and nondeterministic (adversarial) domains. We propose solution techniques for both cases by relying respectively on Markov Decision Processes and on Markov Decision Processes with Set-valued Transitions with LTLf objectives, where the set-valued probabilistic transitions capture both the nondeterminism from the environment and the possible action instruction errors from the agent. We formally show the correctness of our solution techniques and demonstrate their effectiveness experimentally through a proof-of-concept implementation.

Safe POMDP Online Planning among Dynamic Agents via Adaptive Conformal Prediction

Online planning for partially observable Markov decision processes (POMDPs) provides efficient techniques for robot decision-making under uncertainty. However, existing methods fall short of preventing safety violations in dynamic environments. This work presents a novel safe POMDP online planning approach that offers probabilistic safety guarantees amidst environments populated by multiple dynamic agents. Our approach utilizes data-driven trajectory prediction models of dynamic agents and applies Adaptive Conformal Prediction (ACP) for assessing the uncertainties in these predictions. Leveraging the obtained ACP-based trajectory predictions, our approach constructs safety shields on-the-fly to prevent unsafe actions within POMDP online planning. Through experimental evaluation in various dynamic environments using real-world pedestrian trajectory data, the proposed approach has been shown to effectively maintain probabilistic safety guarantees while accommodating up to hundreds of dynamic agents.

HSVI-based Online Minimax Strategies for Partially Observable Stochastic Games with Neural Perception Mechanisms

We consider a variant of continuous-state partially-observable stochastic games with neural perception mechanisms and an asymmetric information structure. One agent has partial information, with the observation function implemented as a neural network, while the other agent is assumed to have full knowledge of the state. We present, for the first time, an efficient online method to compute an $\varepsilon$-minimax strategy profile, which requires only one linear program to be solved for each agent at every stage, instead of a complex estimation of opponent counterfactual values. For the partially-informed agent, we propose a continual resolving approach which uses lower bounds, pre-computed offline with heuristic search value iteration (HSVI), instead of opponent counterfactual values. This inherits the soundness of continual resolving at the cost of pre-computing the bound. For the fully-informed agent, we propose an inferred-belief strategy, where the agent maintains an inferred belief about the belief of the partially-informed agent based on (offline) upper bounds from HSVI, guaranteeing $\varepsilon$-distance to the value of the game at the initial belief known to both agents.

Learning Algorithms for Verification of Markov Decision Processes

We present a general framework for applying learning algorithms and heuristical guidance to the verification of Markov decision processes (MDPs). The primary goal of our techniques is to improve performance by avoiding an exhaustive exploration of the state space, instead focussing on particularly relevant areas of the system, guided by heuristics. Our work builds on the previous results of Br{\'{a}}zdil et al., significantly extending it as well as refining several details and fixing errors. The presented framework focuses on probabilistic reachability, which is a core problem in verification, and is instantiated in two distinct scenarios. The first assumes that full knowledge of the MDP is available, in particular precise transition probabilities. It performs a heuristic-driven partial exploration of the model, yielding precise lower and upper bounds on the required probability. The second tackles the case where we may only sample the MDP without knowing the exact transition dynamics. Here, we obtain probabilistic guarantees, again in terms of both the lower and upper bounds, which provides efficient stopping criteria for the approximation. In particular, the latter is an extension of statistical model-checking (SMC) for unbounded properties in MDPs. In contrast to other related approaches, we do not restrict our attention to time-bounded (finite-horizon) or discounted properties, nor assume any particular structural properties of the MDP.

Uncertainty-Aware Explanations Through Probabilistic Self-Explainable Neural Networks

The lack of transparency of Deep Neural Networks continues to be a limitation that severely undermines their reliability and usage in high-stakes applications. Promising approaches to overcome such limitations are Prototype-Based Self-Explainable Neural Networks (PSENNs), whose predictions rely on the similarity between the input at hand and a set of prototypical representations of the output classes, offering therefore a deep, yet transparent-by-design, architecture. So far, such models have been designed by considering pointwise estimates for the prototypes, which remain fixed after the learning phase of the model. In this paper, we introduce a probabilistic reformulation of PSENNs, called Prob-PSENN, which replaces point estimates for the prototypes with probability distributions over their values. This provides not only a more flexible framework for an end-to-end learning of prototypes, but can also capture the explanatory uncertainty of the model, which is a missing feature in previous approaches. In addition, since the prototypes determine both the explanation and the prediction, Prob-PSENNs allow us to detect when the model is making uninformed or uncertain predictions, and to obtain valid explanations for them. Our experiments demonstrate that Prob-PSENNs provide more meaningful and robust explanations than their non-probabilistic counterparts, thus enhancing the explainability and reliability of the models.