Capturing users' engagement is crucial for gathering feedback about the features of a software product. In a market-driven context, current approaches to collect and analyze users' feedback are based on techniques leveraging information extracted from product reviews and social media. These approaches are hardly applicable in bespoke software development, or in contexts in which one needs to gather information from specific users. In such cases, companies need to resort to face-to-face interviews to get feedback on their products. In this paper, we propose to utilize biometric data, in terms of physiological and voice features, to complement interviews with information about the engagement of the user on the discussed product-relevant topics. We evaluate our approach by interviewing users while gathering their physiological data (i.e., biofeedback) using an Empatica E4 wristband, and capturing their voice through the default audio-recorder of a common laptop. Our results show that we can predict users' engagement by training supervised machine learning algorithms on biometric data (F1=0.72), and that voice features alone are sufficiently effective (F1=0.71). Our work contributes with one the first studies in requirements engineering in which biometrics are used to identify emotions. This is also the first study in software engineering that considers voice analysis. The usage of voice features could be particularly helpful for emotion-aware requirements elicitation in remote communication, either performed by human analysts or voice-based chatbots, and can also be exploited to support the analysis of meetings in software engineering research.

We introduce NCP (Neural Conditional Probability), a novel operator-theoretic approach for learning conditional distributions with a particular focus on inference tasks. NCP can be used to build conditional confidence regions and extract important statistics like conditional quantiles, mean, and covariance. It offers streamlined learning through a single unconditional training phase, facilitating efficient inference without the need for retraining even when conditioning changes. By tapping into the powerful approximation capabilities of neural networks, our method efficiently handles a wide variety of complex probability distributions, effectively dealing with nonlinear relationships between input and output variables. Theoretical guarantees ensure both optimization consistency and statistical accuracy of the NCP method. Our experiments show that our approach matches or beats leading methods using a simple Multi-Layer Perceptron (MLP) with two hidden layers and GELU activations. This demonstrates that a minimalistic architecture with a theoretically grounded loss function can achieve competitive results without sacrificing performance, even in the face of more complex architectures.

In domains with interdependent data, such as graphs, quantifying the epistemic uncertainty of a Graph Neural Network (GNN) is challenging as uncertainty can arise at different structural scales. Existing techniques neglect this issue or only distinguish between structure-aware and structure-agnostic uncertainty without combining them into a single measure. We propose GEBM, an energy-based model (EBM) that provides high-quality uncertainty estimates by aggregating energy at different structural levels that naturally arise from graph diffusion. In contrast to logit-based EBMs, we provably induce an integrable density in the data space by regularizing the energy function. We introduce an evidential interpretation of our EBM that significantly improves the predictive robustness of the GNN. Our framework is a simple and effective post hoc method applicable to any pre-trained GNN that is sensitive to various distribution shifts. It consistently achieves the best separation of in-distribution and out-of-distribution data on 6 out of 7 anomaly types while having the best average rank over shifts on \emph{all} datasets.

We study how abstract representations emerge in a Deep Belief Network (DBN) trained on benchmark datasets. Our analysis targets the principles of learning in the early stages of information processing, starting from the "primordial soup" of the under-sampling regime. As the data is processed by deeper and deeper layers, features are detected and removed, transferring more and more "context-invariant" information to deeper layers. We show that the representation approaches an universal model -- the Hierarchical Feature Model (HFM) -- determined by the principle of maximal relevance. Relevance quantifies the uncertainty on the model of the data, thus suggesting that "meaning" -- i.e. syntactic information -- is that part of the data which is not yet captured by a model. Our analysis shows that shallow layers are well described by pairwise Ising models, which provide a representation of the data in terms of generic, low order features. We also show that plasticity increases with depth, in a similar way as it does in the brain. These findings suggest that DBNs are capable of extracting a hierarchy of features from the data which is consistent with the principle of maximal relevance.

This paper addresses the need for deep learning models to integrate well-defined constraints into their outputs, driven by their application in surrogate models, learning with limited data and partial information, and scenarios requiring flexible model behavior to incorporate non-data sample information. We introduce Bayesian Entropy Neural Networks (BENN), a framework grounded in Maximum Entropy (MaxEnt) principles, designed to impose constraints on Bayesian Neural Network (BNN) predictions. BENN is capable of constraining not only the predicted values but also their derivatives and variances, ensuring a more robust and reliable model output. To achieve simultaneous uncertainty quantification and constraint satisfaction, we employ the method of multipliers approach. This allows for the concurrent estimation of neural network parameters and the Lagrangian multipliers associated with the constraints. Our experiments, spanning diverse applications such as beam deflection modeling and microstructure generation, demonstrate the effectiveness of BENN. The results highlight significant improvements over traditional BNNs and showcase competitive performance relative to contemporary constrained deep learning methods.

In this paper we describe a new conceptual framework that connects approximate Dynamic Programming (DP), Model Predictive Control (MPC), and Reinforcement Learning (RL). This framework centers around two algorithms, which are designed largely independently of each other and operate in synergy through the powerful mechanism of Newton's method. We call them the off-line training and the on-line play algorithms. The names are borrowed from some of the major successes of RL involving games; primary examples are the recent (2017) AlphaZero program (which plays chess, [SHS17], [SSS17]), and the similarly structured and earlier (1990s) TD-Gammon program (which plays backgammon, [Tes94], [Tes95], [TeG96]). In these game contexts, the off-line training algorithm is the method used to teach the program how to evaluate positions and to generate good moves at any given position, while the on-line play algorithm is the method used to play in real time against human or computer opponents. Significantly, the synergy between off-line training and on-line play also underlies MPC (as well as other major classes of sequential decision problems), and indeed the MPC design architecture is very similar to the one of AlphaZero and TD-Gammon. This conceptual insight provides a vehicle for bridging the cultural gap between RL and MPC, and sheds new light on some fundamental issues in MPC. These include the enhancement of stability properties through rollout, the treatment of uncertainty through the use of certainty equivalence, the resilience of MPC in adaptive control settings that involve changing system parameters, and the insights provided by the superlinear performance bounds implied by Newton's method.

Black-box optimization (BBO) aims to optimize an objective function by iteratively querying a black-box oracle. This process demands sample-efficient optimization due to the high computational cost of function evaluations. While prior studies focus on forward approaches to learn surrogates for the unknown objective function, they struggle with high-dimensional inputs where valid inputs form a small subspace (e.g., valid protein sequences), which is common in real-world tasks. Recently, diffusion models have demonstrated impressive capability in learning the high-dimensional data manifold. They have shown promising performance in black-box optimization tasks but only in offline settings. In this work, we propose diffusion-based inverse modeling for black-box optimization (Diff-BBO), the first inverse approach leveraging diffusion models for online BBO problem. Diff-BBO distinguishes itself from forward approaches through the design of acquisition function. Instead of proposing candidates in the design space, Diff-BBO employs a novel acquisition function Uncertainty-aware Exploration (UaE) to propose objective function values, which leverages the uncertainty of a conditional diffusion model to generate samples in the design space. Theoretically, we prove that using UaE leads to optimal optimization outcomes. Empirically, we redesign experiments on the Design-Bench benchmark for online settings and show that Diff-BBO achieves state-of-the-art performance.

Uncertainty-aware controllers that guarantee safety are critical for safety critical applications. Among such controllers, Control Barrier Functions (CBFs) based approaches are popular because they are fast, yet safe. However, most such works depend on Gaussian Processes (GPs) or MC-Dropout for learning and uncertainty estimation, and both approaches come with drawbacks: GPs are non-parametric methods that are slow, while MC-Dropout does not capture aleatoric uncertainty. On the other hand, modern Bayesian learning algorithms have shown promise in uncertainty quantification. The application of modern Bayesian learning methods to CBF-based controllers has not yet been studied. We aim to fill this gap by surveying uncertainty quantification algorithms and evaluating them on CBF-based safe controllers. We find that model variance-based algorithms (for example, Deep ensembles, MC-dropout, etc.) and direct estimation-based algorithms (such as DEUP) have complementary strengths. Algorithms in the former category can only estimate uncertainty accurately out-of-domain, while those in the latter category can only do so in-domain. We combine the two approaches to obtain more accurate uncertainty estimates both in- and out-of-domain. As measured by the failure rate of a simulated robot, this results in a safer CBF-based robot controller.

We study the problem of exploration in Reinforcement Learning and present a novel model-free solution. We adopt an information-theoretical viewpoint and start from the instance-specific lower bound of the number of samples that have to be collected to identify a nearly-optimal policy. Deriving this lower bound along with the optimal exploration strategy entails solving an intricate optimization problem and requires a model of the system. In turn, most existing sample optimal exploration algorithms rely on estimating the model. We derive an approximation of the instance-specific lower bound that only involves quantities that can be inferred using model-free approaches. Leveraging this approximation, we devise an ensemble-based model-free exploration strategy applicable to both tabular and continuous Markov decision processes. Numerical results demonstrate that our strategy is able to identify efficient policies faster than state-of-the-art exploration approaches.

In this paper, we introduce innovative approaches for accelerating the Jacobi method for matrix diagonalization, specifically through the formulation of large matrix diagonalization as a Semi-Markov Decision Process and small matrix diagonalization as a Markov Decision Process. Furthermore, we examine the potential of utilizing scalable architecture between different-sized matrices. During a short training period, our method discovered a significant reduction in the number of steps required for diagonalization and exhibited efficient inference capabilities. Importantly, this approach demonstrated possible scalability to large-sized matrices, indicating its potential for wide-ranging applicability. Upon training completion, we obtain action-state probabilities and transition graphs, which depict transitions between different states. These outputs not only provide insights into the diagonalization process but also pave the way for cost savings pertinent to large-scale matrices. The advancements made in this research enhance the efficacy and scalability of matrix diagonalization, pushing for new possibilities for deployment in practical applications in scientific and engineering domains.