Learning Graphical Models
RAG-based Explainable Prediction of Road Users Behaviors for Automated Driving using Knowledge Graphs and Large Language Models
Hussien, Mohamed Manzour, Melo, Angie Nataly, Ballardini, Augusto Luis, Maldonado, Carlota Salinas, Izquierdo, Rubén, Sotelo, Miguel Ángel
Prediction of road users' behaviors in the context of autonomous driving has gained considerable attention by the scientific community in the last years. Most works focus on predicting behaviors based on kinematic information alone, a simplification of the reality since road users are humans, and as such they are highly influenced by their surrounding context. In addition, a large plethora of research works rely on powerful Deep Learning techniques, which exhibit high performance metrics in prediction tasks but may lack the ability to fully understand and exploit the contextual semantic information contained in the road scene, not to mention their inability to provide explainable predictions that can be understood by humans. In this work, we propose an explainable road users' behavior prediction system that integrates the reasoning abilities of Knowledge Graphs (KG) and the expressiveness capabilities of Large Language Models (LLM) by using Retrieval Augmented Generation (RAG) techniques. For that purpose, Knowledge Graph Embeddings (KGE) and Bayesian inference are combined to allow the deployment of a fully inductive reasoning system that enables the issuing of predictions that rely on legacy information contained in the graph as well as on current evidence gathered in real time by onboard sensors. Two use cases have been implemented following the proposed approach: 1) Prediction of pedestrians' crossing actions; 2) Prediction of lane change maneuvers. In both cases, the performance attained surpasses the current state of the art in terms of anticipation and F1-score, showing a promising avenue for future research in this field.
Loose LIPS Sink Ships: Asking Questions in Battleship with Language-Informed Program Sampling
Grand, Gabriel, Pepe, Valerio, Andreas, Jacob, Tenenbaum, Joshua B.
Questions combine our mastery of language with our remarkable facility for reasoning about uncertainty. How do people navigate vast hypothesis spaces to pose informative questions given limited cognitive resources? We study these tradeoffs in a classic grounded question-asking task based on the board game Battleship. Our language-informed program sampling (LIPS) model uses large language models (LLMs) to generate natural language questions, translate them into symbolic programs, and evaluate their expected information gain. We find that with a surprisingly modest resource budget, this simple Monte Carlo optimization strategy yields informative questions that mirror human performance across varied Battleship board scenarios. In contrast, LLM-only baselines struggle to ground questions in the board state; notably, GPT-4V provides no improvement over non-visual baselines. Our results illustrate how Bayesian models of question-asking can leverage the statistics of language to capture human priors, while highlighting some shortcomings of pure LLMs as grounded reasoners.
ConstrainedZero: Chance-Constrained POMDP Planning using Learned Probabilistic Failure Surrogates and Adaptive Safety Constraints
Moss, Robert J., Jamgochian, Arec, Fischer, Johannes, Corso, Anthony, Kochenderfer, Mykel J.
To plan safely in uncertain environments, agents must balance utility with safety constraints. Safe planning problems can be modeled as a chance-constrained partially observable Markov decision process (CC-POMDP) and solutions often use expensive rollouts or heuristics to estimate the optimal value and action-selection policy. This work introduces the ConstrainedZero policy iteration algorithm that solves CC-POMDPs in belief space by learning neural network approximations of the optimal value and policy with an additional network head that estimates the failure probability given a belief. This failure probability guides safe action selection during online Monte Carlo tree search (MCTS). To avoid overemphasizing search based on the failure estimates, we introduce $\Delta$-MCTS, which uses adaptive conformal inference to update the failure threshold during planning. The approach is tested on a safety-critical POMDP benchmark, an aircraft collision avoidance system, and the sustainability problem of safe CO$_2$ storage. Results show that by separating safety constraints from the objective we can achieve a target level of safety without optimizing the balance between rewards and costs.
Discovering robust biomarkers of neurological disorders from functional MRI using graph neural networks: A Review
Chan, Yi Hao, Girish, Deepank, Gupta, Sukrit, Xia, Jing, Kasi, Chockalingam, He, Yinan, Wang, Conghao, Rajapakse, Jagath C.
Graph neural networks (GNN) have emerged as a popular tool for modelling functional magnetic resonance imaging (fMRI) datasets. Many recent studies have reported significant improvements in disorder classification performance via more sophisticated GNN designs and highlighted salient features that could be potential biomarkers of the disorder. In this review, we provide an overview of how GNN and model explainability techniques have been applied on fMRI datasets for disorder prediction tasks, with a particular emphasis on the robustness of biomarkers produced for neurodegenerative diseases and neuropsychiatric disorders. We found that while most studies have performant models, salient features highlighted in these studies vary greatly across studies on the same disorder and little has been done to evaluate their robustness. To address these issues, we suggest establishing new standards that are based on objective evaluation metrics to determine the robustness of these potential biomarkers. We further highlight gaps in the existing literature and put together a prediction-attribution-evaluation framework that could set the foundations for future research on improving the robustness of potential biomarkers discovered via GNNs.
Causal Evaluation of Language Models
Chen, Sirui, Peng, Bo, Chen, Meiqi, Wang, Ruiqi, Xu, Mengying, Zeng, Xingyu, Zhao, Rui, Zhao, Shengjie, Qiao, Yu, Lu, Chaochao
Causal reasoning is viewed as crucial for achieving human-level machine intelligence. Recent advances in language models have expanded the horizons of artificial intelligence across various domains, sparking inquiries into their potential for causal reasoning. In this work, we introduce Causal evaluation of Language Models (CaLM), which, to the best of our knowledge, is the first comprehensive benchmark for evaluating the causal reasoning capabilities of language models. First, we propose the CaLM framework, which establishes a foundational taxonomy consisting of four modules: causal target (i.e., what to evaluate), adaptation (i.e., how to obtain the results), metric (i.e., how to measure the results), and error (i.e., how to analyze the bad results). This taxonomy defines a broad evaluation design space while systematically selecting criteria and priorities. Second, we compose the CaLM dataset, comprising 126,334 data samples, to provide curated sets of causal targets, adaptations, metrics, and errors, offering extensive coverage for diverse research pursuits. Third, we conduct an extensive evaluation of 28 leading language models on a core set of 92 causal targets, 9 adaptations, 7 metrics, and 12 error types. Fourth, we perform detailed analyses of the evaluation results across various dimensions (e.g., adaptation, scale). Fifth, we present 50 high-level empirical findings across 9 dimensions (e.g., model), providing valuable guidance for future language model development. Finally, we develop a multifaceted platform, including a website, leaderboards, datasets, and toolkits, to support scalable and adaptable assessments. We envision CaLM as an ever-evolving benchmark for the community, systematically updated with new causal targets, adaptations, models, metrics, and error types to reflect ongoing research advancements. Project website is at https://opencausalab.github.io/CaLM.
U-Nets as Belief Propagation: Efficient Classification, Denoising, and Diffusion in Generative Hierarchical Models
U-Nets are among the most widely used architectures in computer vision, renowned for their exceptional performance in applications such as image segmentation, denoising, and diffusion modeling. However, a theoretical explanation of the U-Net architecture design has not yet been fully established. This paper introduces a novel interpretation of the U-Net architecture by studying certain generative hierarchical models, which are tree-structured graphical models extensively utilized in both language and image domains. With their encoder-decoder structure, long skip connections, and pooling and up-sampling layers, we demonstrate how U-Nets can naturally implement the belief propagation denoising algorithm in such generative hierarchical models, thereby efficiently approximating the denoising functions. This leads to an efficient sample complexity bound for learning the denoising function using U-Nets within these models. Additionally, we discuss the broader implications of these findings for diffusion models in generative hierarchical models. We also demonstrate that the conventional architecture of convolutional neural networks (ConvNets) is ideally suited for classification tasks within these models. This offers a unified view of the roles of ConvNets and U-Nets, highlighting the versatility of generative hierarchical models in modeling complex data distributions across language and image domains.
Provably Efficient Reinforcement Learning for Adversarial Restless Multi-Armed Bandits with Unknown Transitions and Bandit Feedback
Restless multi-armed bandits (RMAB) play a central role in modeling sequential decision making problems under an instantaneous activation constraint that at most B arms can be activated at any decision epoch. Each restless arm is endowed with a state that evolves independently according to a Markov decision process regardless of being activated or not. In this paper, we consider the task of learning in episodic RMAB with unknown transition functions and adversarial rewards, which can change arbitrarily across episodes. Further, we consider a challenging but natural bandit feedback setting that only adversarial rewards of activated arms are revealed to the decision maker (DM). The goal of the DM is to maximize its total adversarial rewards during the learning process while the instantaneous activation constraint must be satisfied in each decision epoch. We develop a novel reinforcement learning algorithm with two key contributors: a novel biased adversarial reward estimator to deal with bandit feedback and unknown transitions, and a low-complexity index policy to satisfy the instantaneous activation constraint. We show $\tilde{\mathcal{O}}(H\sqrt{T})$ regret bound for our algorithm, where $T$ is the number of episodes and $H$ is the episode length. To our best knowledge, this is the first algorithm to ensure $\tilde{\mathcal{O}}(\sqrt{T})$ regret for adversarial RMAB in our considered challenging settings.
Variational Bayesian Methods for a Tree-Structured Stick-Breaking Process Mixture of Gaussians
The Bayes coding algorithm for context tree source is a successful example of Bayesian tree estimation in text compression in information theory. This algorithm provides an efficient parametric representation of the posterior tree distribution and exact updating of its parameters. We apply this algorithm to a clustering task in machine learning. More specifically, we apply it to Bayesian estimation of the tree-structured stick-breaking process (TS-SBP) mixture models. For TS-SBP mixture models, only Markov chain Monte Carlo methods have been proposed so far, but any variational Bayesian methods have not been proposed yet. In this paper, we propose a variational Bayesian method that has a subroutine similar to the Bayes coding algorithm for context tree sources. We confirm its behavior by a numerical experiment on a toy example.
Structure learning of Hamiltonians from real-time evolution
Bakshi, Ainesh, Liu, Allen, Moitra, Ankur, Tang, Ewin
We initiate the study of Hamiltonian structure learning from real-time evolution: given the ability to apply $e^{-\mathrm{i} Ht}$ for an unknown local Hamiltonian $H = \sum_{a = 1}^m \lambda_a E_a$ on $n$ qubits, the goal is to recover $H$. This problem is already well-studied under the assumption that the interaction terms, $E_a$, are given, and only the interaction strengths, $\lambda_a$, are unknown. But is it possible to learn a local Hamiltonian without prior knowledge of its interaction structure? We present a new, general approach to Hamiltonian learning that not only solves the challenging structure learning variant, but also resolves other open questions in the area, all while achieving the gold standard of Heisenberg-limited scaling. In particular, our algorithm recovers the Hamiltonian to $\varepsilon$ error with an evolution time scaling with $1/\varepsilon$, and has the following appealing properties: (1) it does not need to know the Hamiltonian terms; (2) it works beyond the short-range setting, extending to any Hamiltonian $H$ where the sum of terms interacting with a qubit has bounded norm; (3) it evolves according to $H$ in constant time $t$ increments, thus achieving constant time resolution. To our knowledge, no prior algorithm with Heisenberg-limited scaling existed with even one of these properties. As an application, we can also learn Hamiltonians exhibiting power-law decay up to accuracy $\varepsilon$ with total evolution time beating the standard limit of $1/\varepsilon^2$.
Complex contagions can outperform simple contagions for network reconstruction with dense networks or saturated dynamics
Landry, Nicholas W., Thompson, William, Hébert-Dufresne, Laurent, Young, Jean-Gabriel
Network scientists often use complex dynamic processes to describe network contagions, but tools for fitting contagion models typically assume simple dynamics. Here, we address this gap by developing a nonparametric method to reconstruct a network and dynamics from a series of node states, using a model that breaks the dichotomy between simple pairwise and complex neighborhood-based contagions. We then show that a network is more easily reconstructed when observed through the lens of complex contagions if it is dense or the dynamic saturates, and that simple contagions are better otherwise.