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Robert Peharz

Publications and source records attributed to Robert Peharz.

At least 19 recordsLinked to original sources

Probabilistic Circuits as Reasoning Machines in Artificial Intelligence (Part I)

This cumulative habilitation thesis studies probabilistic circuits (PCs) as a powerful and tractable framework for reasoning and learning under uncertainty in artificial intelligence (AI). It first advocates for probability as a core language for AI, emphasizing its connections to logic and information theory; the conceptual simplicity of probabilistic reasoning---based primarily on the sum and product rules; the parallels between probabilistic inference and human cognition; and the role of probability in optimal decision making. However, probability also faces significant computational challenges, as probabilistic inference is NP-hard in almost all probabilistic models. PCs address these challenges through structural constraints that ensure exact computation of a wide range of inference queries in polynomial time, such as marginals, conditionals, most probable explanations, expectations, and more advanced inference tasks. This thesis synthesizes a decade of research across foundations, algorithmic developments, and empirical validation of PCs. Key contributions highlighted in this work are foundational theory of PCs, Bayesian approaches for learning PCs, scalable implementations and integration with deep learning, hybrid models that combine PCs with intractable models, and connections with symbolic machine learning paradigms. This is the first part of my Habilitation Thesis. The second part is omitted, as it comprises the cumulative part of the thesis and has been published at various venues (see Chapter 5).

cs.AI

The RAIL Principles for Neurosymbolic AI: Reasoning, Assurances, Interfacing and Learning

Neurosymbolic AI systems that integrate machine learning and symbolic reasoning are rapidly gaining attention. They complement the data-intensive statistical approaches of neural networks and language models with symbolic reasoning algorithms to function in high-stakes domains or in low-data regimes that characterize many real-world applications. We argue that the neurosymbolic combination of machine learning and formal reasoning is not a niche approach within AI, but rather includes many already successful techniques that are of crucial importance to the development of reliable, efficient and, ultimately, trustworthy systems. This perspective prompts a re-examination of the design of current AI systems. We show that many leading AI systems, including some that are not traditionally considered as neurosymbolic, can be analysed from the perspective of four principles of neurosymbolic AI design: Reasoning, Assurances, Interfacing and Learning (RAIL). Applying the RAIL framework offers a unified view of seemingly disparate AI systems, ranging from physics-aware machine learning to neuro-guided search (such as Google DeepMind's Alpha-* suite), causal learning and tool-augmented Large Language Models. Importantly, the RAIL principles will enable engineers to make better-informed and more principled decisions about the design and deployment of production-level AI systems. In this article, we introduce the RAIL principles, examine how they can be applied across major areas of AI, and illustrate how they may guide practitioners to integrate neurosymbolic methods into next-generation AI technologies.

cs.AI

Teaching LLMs a Low-Resource Language: Enhancing Code Completion in Pharo

Large Language Models (LLMs) unlocked new possibilities in automated code writing, becoming the backbone of most code completion tools. While LLMs excel in mainstream languages, they often lack support for the so-called low-resource languages where training data is scarce. As a result, these languages lag behind in the quality of code completion tooling available to their communities. A concrete example is Pharo, a Smalltalk-inspired language whose IDE currently offers only single-token completion. In this work, we report on our experience bringing LLM-based code completion to Pharo. First, we describe an end-to-end pipeline that combines Pharo-specific data curation, continued pre-training and fine-tuning of open code LLMs. Second, we introduce a set of Pharo code completion benchmarks designed to evaluate whether models (i) learn Pharo's syntax and (ii) accurately complete masked Pharo code from real-world GitHub repositories. Third, we show empirically that Pharo-specialized models substantially outperform their original base checkpoints and also exceed the accuracy of substantially larger code LLMs on Pharo completion. Overall, our case study demonstrates the feasibility of bringing strong LLM-based code completion to low-resource programming languages, with models small enough to provide ``real-time'' in-IDE support.

cs.SE

Deep Polynomial Chaos Expansion

Polynomial chaos expansion (PCE) is a classical and widely used surrogate modeling technique in physical simulation and uncertainty quantification. By taking a linear combination of a set of basis polynomials - orthonormal with respect to the distribution of uncertain input parameters - PCE enables tractable inference of key statistical quantities such as (conditional) means, variances, covariances, and Sobol sensitivity indices, which are essential for understanding the modeled system and identifying influential parameters and their interactions. The applicability of PCE to high-dimensional problems is limited by poor scalability, as the number of basis functions grows exponentially with the number of parameters. In this paper, we address this challenge by combining PCE with ideas from tractable probabilistic circuits, resulting in deep polynomial chaos expansion (DeepPCE) - a deep generalization of PCE that scales effectively to high-dimensional input spaces. DeepPCE achieves predictive performance comparable to that of multilayer perceptrons (MLPs), while retaining PCE's ability to compute exact statistical inferences via simple forward passes. In contrast, such computations in MLPs require costly and often inaccurate approximations, such as Monte Carlo integration.

cs.LG

Einsum Networks: Fast and Scalable Learning of Tractable Probabilistic Circuits

Probabilistic circuits (PCs) are a promising avenue for probabilistic modeling, as they permit a wide range of exact and efficient inference routines. Recent ``deep-learning-style'' implementations of PCs strive for a better scalability, but are still difficult to train on real-world data, due to their sparsely connected computational graphs. In this paper, we propose Einsum Networks (EiNets), a novel implementation design for PCs, improving prior art in several regards. At their core, EiNets combine a large number of arithmetic operations in a single monolithic einsum-operation, leading to speedups and memory savings of up to two orders of magnitude, in comparison to previous implementations. As an algorithmic contribution, we show that the implementation of Expectation-Maximization (EM) can be simplified for PCs, by leveraging automatic differentiation. Furthermore, we demonstrate that EiNets scale well to datasets which were previously out of reach, such as SVHN and CelebA, and that they can be used as faithful generative image models.

cs.LG

Effective Bayesian Causal Inference via Structural Marginalisation and Autoregressive Orders

The traditional two-stage approach to causal inference first identifies a single causal model (or equivalence class of models), which is then used to answer causal queries. However, this neglects any epistemic model uncertainty. In contrast, Bayesian causal inference does incorporate epistemic uncertainty into query estimates via Bayesian marginalisation (posterior averaging) over all causal models. While principled, this marginalisation over entire causal models, i.e., both causal structures (graphs) and mechanisms, poses a tremendous computational challenge. In this work, we address this challenge by decomposing structure marginalisation into the marginalisation over (i) causal orders and (ii) directed acyclic graphs (DAGs) given an order. We can marginalise the latter in closed form by limiting the number of parents per variable and utilising Gaussian processes to model mechanisms. To marginalise over orders, we use a sampling-based approximation, for which we devise a novel auto-regressive distribution over causal orders (ARCO). Our method outperforms state-of-the-art in structure learning on simulated non-linear additive noise benchmarks, and yields competitive results on real-world data. Furthermore, we can accurately infer interventional distributions and average causal effects.

cs.LG

What is the Relationship between Tensor Factorizations and Circuits (and How Can We Exploit it)?

This paper establishes a rigorous connection between circuit representations and tensor factorizations, two seemingly distinct yet fundamentally related areas. By connecting these fields, we highlight a series of opportunities that can benefit both communities. Our work generalizes popular tensor factorizations within the circuit language, and unifies various circuit learning algorithms under a single, generalized hierarchical factorization framework. Specifically, we introduce a modular "Lego block" approach to build tensorized circuit architectures. This, in turn, allows us to systematically construct and explore various circuit and tensor factorization models while maintaining tractability. This connection not only clarifies similarities and differences in existing models, but also enables the development of a comprehensive pipeline for building and optimizing new circuit/tensor factorization architectures. We show the effectiveness of our framework through extensive empirical evaluations, and highlight new research opportunities for tensor factorizations in probabilistic modeling.

cs.LG

Exact Soft Analytical Side-Channel Attacks using Tractable Circuits

Detecting weaknesses in cryptographic algorithms is of utmost importance for designing secure information systems. The state-of-the-art soft analytical side-channel attack (SASCA) uses physical leakage information to make probabilistic predictions about intermediate computations and combines these "guesses" with the known algorithmic logic to compute the posterior distribution over the key. This attack is commonly performed via loopy belief propagation, which, however, lacks guarantees in terms of convergence and inference quality. In this paper, we develop a fast and exact inference method for SASCA, denoted as ExSASCA, by leveraging knowledge compilation and tractable probabilistic circuits. When attacking the Advanced Encryption Standard (AES), the most widely used encryption algorithm to date, ExSASCA outperforms SASCA by more than 31% top-1 success rate absolute. By leveraging sparse belief messages, this performance is achieved with little more computational cost than SASCA, and about 3 orders of magnitude less than exact inference via exhaustive enumeration. Even with dense belief messages, ExSASCA still uses 6 times less computations than exhaustive inference.

cs.LG

One-Shot Federated Learning with Bayesian Pseudocoresets

Optimization-based techniques for federated learning (FL) often come with prohibitive communication cost, as high dimensional model parameters need to be communicated repeatedly between server and clients. In this paper, we follow a Bayesian approach allowing to perform FL with one-shot communication, by solving the global inference problem as a product of local client posteriors. For models with multi-modal likelihoods, such as neural networks, a naive application of this scheme is hampered, since clients will capture different posterior modes, causing a destructive collapse of the posterior on the server side. Consequently, we explore approximate inference in the function-space representation of client posteriors, hence suffering less or not at all from multi-modality. We show that distributed function-space inference is tightly related to learning Bayesian pseudocoresets and develop a tractable Bayesian FL algorithm on this insight. We show that this approach achieves prediction performance competitive to state-of-the-art while showing a striking reduction in communication cost of up to two orders of magnitude. Moreover, due to its Bayesian nature, our method also delivers well-calibrated uncertainty estimates.

cs.LG

Resource-Efficient Neural Networks for Embedded Systems

While machine learning is traditionally a resource intensive task, embedded systems, autonomous navigation, and the vision of the Internet of Things fuel the interest in resource-efficient approaches. These approaches aim for a carefully chosen trade-off between performance and resource consumption in terms of computation and energy. The development of such approaches is among the major challenges in current machine learning research and key to ensure a smooth transition of machine learning technology from a scientific environment with virtually unlimited computing resources into everyday's applications. In this article, we provide an overview of the current state of the art of machine learning techniques facilitating these real-world requirements. In particular, we focus on resource-efficient inference based on deep neural networks (DNNs), the predominant machine learning models of the past decade. We give a comprehensive overview of the vast literature that can be mainly split into three non-mutually exclusive categories: (i) quantized neural networks, (ii) network pruning, and (iii) structural efficiency. These techniques can be applied during training or as post-processing, and they are widely used to reduce the computational demands in terms of memory footprint, inference speed, and energy efficiency. We also briefly discuss different concepts of embedded hardware for DNNs and their compatibility with machine learning techniques as well as potential for energy and latency reduction. We substantiate our discussion with experiments on well-known benchmark data sets using compression techniques (quantization, pruning) for a set of resource-constrained embedded systems, such as CPUs, GPUs and FPGAs. The obtained results highlight the difficulty of finding good trade-offs between resource efficiency and prediction quality.

stat.ML

How to Turn Your Knowledge Graph Embeddings into Generative Models

Some of the most successful knowledge graph embedding (KGE) models for link prediction -- CP, RESCAL, TuckER, ComplEx -- can be interpreted as energy-based models. Under this perspective they are not amenable for exact maximum-likelihood estimation (MLE), sampling and struggle to integrate logical constraints. This work re-interprets the score functions of these KGEs as circuits -- constrained computational graphs allowing efficient marginalisation. Then, we design two recipes to obtain efficient generative circuit models by either restricting their activations to be non-negative or squaring their outputs. Our interpretation comes with little or no loss of performance for link prediction, while the circuits framework unlocks exact learning by MLE, efficient sampling of new triples, and guarantee that logical constraints are satisfied by design. Furthermore, our models scale more gracefully than the original KGEs on graphs with millions of entities.

cs.LG

Probabilistic Integral Circuits

Continuous latent variables (LVs) are a key ingredient of many generative models, as they allow modelling expressive mixtures with an uncountable number of components. In contrast, probabilistic circuits (PCs) are hierarchical discrete mixtures represented as computational graphs composed of input, sum and product units. Unlike continuous LV models, PCs provide tractable inference but are limited to discrete LVs with categorical (i.e. unordered) states. We bridge these model classes by introducing probabilistic integral circuits (PICs), a new language of computational graphs that extends PCs with integral units representing continuous LVs. In the first place, PICs are symbolic computational graphs and are fully tractable in simple cases where analytical integration is possible. In practice, we parameterise PICs with light-weight neural nets delivering an intractable hierarchical continuous mixture that can be approximated arbitrarily well with large PCs using numerical quadrature. On several distribution estimation benchmarks, we show that such PIC-approximating PCs systematically outperform PCs commonly learned via expectation-maximization or SGD.

cs.LG

Continuous Mixtures of Tractable Probabilistic Models

Probabilistic models based on continuous latent spaces, such as variational autoencoders, can be understood as uncountable mixture models where components depend continuously on the latent code. They have proven to be expressive tools for generative and probabilistic modelling, but are at odds with tractable probabilistic inference, that is, computing marginals and conditionals of the represented probability distribution. Meanwhile, tractable probabilistic models such as probabilistic circuits (PCs) can be understood as hierarchical discrete mixture models, and thus are capable of performing exact inference efficiently but often show subpar performance in comparison to continuous latent-space models. In this paper, we investigate a hybrid approach, namely continuous mixtures of tractable models with a small latent dimension. While these models are analytically intractable, they are well amenable to numerical integration schemes based on a finite set of integration points. With a large enough number of integration points the approximation becomes de-facto exact. Moreover, for a finite set of integration points, the integration method effectively compiles the continuous mixture into a standard PC. In experiments, we show that this simple scheme proves remarkably effective, as PCs learnt this way set new state of the art for tractable models on many standard density estimation benchmarks.

cs.LG

Bayesian Structure Scores for Probabilistic Circuits

Probabilistic circuits (PCs) are a prominent representation of probability distributions with tractable inference. While parameter learning in PCs is rigorously studied, structure learning is often more based on heuristics than on principled objectives. In this paper, we develop Bayesian structure scores for deterministic PCs, i.e., the structure likelihood with parameters marginalized out, which are well known as rigorous objectives for structure learning in probabilistic graphical models. When used within a greedy cutset algorithm, our scores effectively protect against overfitting and yield a fast and almost hyper-parameter-free structure learner, distinguishing it from previous approaches. In experiments, we achieve good trade-offs between training time and model fit in terms of log-likelihood. Moreover, the principled nature of Bayesian scores unlocks PCs for accommodating frameworks such as structural expectation-maximization.

cs.LG

Active Bayesian Causal Inference

Causal discovery and causal reasoning are classically treated as separate and consecutive tasks: one first infers the causal graph, and then uses it to estimate causal effects of interventions. However, such a two-stage approach is uneconomical, especially in terms of actively collected interventional data, since the causal query of interest may not require a fully-specified causal model. From a Bayesian perspective, it is also unnatural, since a causal query (e.g., the causal graph or some causal effect) can be viewed as a latent quantity subject to posterior inference -- other unobserved quantities that are not of direct interest (e.g., the full causal model) ought to be marginalized out in this process and contribute to our epistemic uncertainty. In this work, we propose Active Bayesian Causal Inference (ABCI), a fully-Bayesian active learning framework for integrated causal discovery and reasoning, which jointly infers a posterior over causal models and queries of interest. In our approach to ABCI, we focus on the class of causally-sufficient, nonlinear additive noise models, which we model using Gaussian processes. We sequentially design experiments that are maximally informative about our target causal query, collect the corresponding interventional data, and update our beliefs to choose the next experiment. Through simulations, we demonstrate that our approach is more data-efficient than several baselines that only focus on learning the full causal graph. This allows us to accurately learn downstream causal queries from fewer samples while providing well-calibrated uncertainty estimates for the quantities of interest.

cs.LG

Joints in Random Forests

Decision Trees (DTs) and Random Forests (RFs) are powerful discriminative learners and tools of central importance to the everyday machine learning practitioner and data scientist. Due to their discriminative nature, however, they lack principled methods to process inputs with missing features or to detect outliers, which requires pairing them with imputation techniques or a separate generative model. In this paper, we demonstrate that DTs and RFs can naturally be interpreted as generative models, by drawing a connection to Probabilistic Circuits, a prominent class of tractable probabilistic models. This reinterpretation equips them with a full joint distribution over the feature space and leads to Generative Decision Trees (GeDTs) and Generative Forests (GeFs), a family of novel hybrid generative-discriminative models. This family of models retains the overall characteristics of DTs and RFs while additionally being able to handle missing features by means of marginalisation. Under certain assumptions, frequently made for Bayes consistency results, we show that consistency in GeDTs and GeFs extend to any pattern of missing input features, if missing at random. Empirically, we show that our models often outperform common routines to treat missing data, such as K-nearest neighbour imputation, and moreover, that our models can naturally detect outliers by monitoring the marginal probability of input features.

cs.LG

Towards Robust Classification with Deep Generative Forests

Decision Trees and Random Forests are among the most widely used machine learning models, and often achieve state-of-the-art performance in tabular, domain-agnostic datasets. Nonetheless, being primarily discriminative models they lack principled methods to manipulate the uncertainty of predictions. In this paper, we exploit Generative Forests (GeFs), a recent class of deep probabilistic models that addresses these issues by extending Random Forests to generative models representing the full joint distribution over the feature space. We demonstrate that GeFs are uncertainty-aware classifiers, capable of measuring the robustness of each prediction as well as detecting out-of-distribution samples.

stat.ML

Sum-Product Network Decompilation

There exists a dichotomy between classical probabilistic graphical models, such as Bayesian networks (BNs), and modern tractable models, such as sum-product networks (SPNs). The former generally have intractable inference, but provide a high level of interpretability, while the latter admits a wide range of tractable inference routines, but are typically harder to interpret. Due to this dichotomy, tools to convert between BNs and SPNs are desirable. While one direction -- compiling BNs into SPNs -- is well discussed in Darwiche's seminal work on arithmetic circuit compilation, the converse direction -- decompiling SPNs into BNs -- has received surprisingly little attention. In this paper, we fill this gap by proposing SPN2BN, an algorithm that decompiles an SPN into a BN. SPN2BN has several salient features when compared to the only other two works decompiling SPNs. Most significantly, the BNs returned by SPN2BN are minimal independence-maps that are more parsimonious with respect to the introduction of latent variables. Secondly, the output BN produced by SPN2BN can be precisely characterized with respect to a compiled BN. More specifically, a certain set of directed edges will be added to the input BN, giving what we will call the moral-closure. Lastly, it is established that our compilation-decompilation process is idempotent. This has practical significance as it limits the size of the decompiled SPN.

cs.AI