Quantum computing has recently emerged as a transformative technology. Yet, its promised advantages rely on efficiently translating quantum operations into viable physical realizations. In this work, we use generative machine learning models, specifically denoising diffusion models (DMs), to facilitate this transformation. Leveraging text-conditioning, we steer the model to produce desired quantum operations within gate-based quantum circuits. Notably, DMs allow to sidestep during training the exponential overhead inherent in the classical simulation of quantum dynamics -- a consistent bottleneck in preceding ML techniques. We demonstrate the model's capabilities across two tasks: entanglement generation and unitary compilation. The model excels at generating new circuits and supports typical DM extensions such as masking and editing to, for instance, align the circuit generation to the constraints of the targeted quantum device. Given their flexibility and generalization abilities, we envision DMs as pivotal in quantum circuit synthesis, enhancing both practical applications but also insights into theoretical quantum computation.

Most applications of Artificial Intelligence (AI) are designed for a confined and specific task. However, there are many scenarios that call for a more general AI, capable of solving a wide array of tasks without being specifically designed for them. The term General-Purpose Artificial Intelligence Systems (GPAIS) has been defined to refer to these AI systems. To date, the possibility of an Artificial General Intelligence, powerful enough to perform any intellectual task as if it were human, or even improve it, has remained an aspiration, fiction, and considered a risk for our society. Whilst we might still be far from achieving that, GPAIS is a reality and sitting at the forefront of AI research. This work discusses existing definitions for GPAIS and proposes a new definition that allows for a gradual differentiation among types of GPAIS according to their properties and limitations. We distinguish between closed-world and open-world GPAIS, characterising their degree of autonomy and ability based on several factors such as adaptation to new tasks, competence in domains not intentionally trained for, ability to learn from few data, or proactive acknowledgment of their own limitations. We propose a taxonomy of approaches to realise GPAIS, describing research trends such as the use of AI techniques to improve another AI (AI-powered AI) or (single) foundation models. As a prime example, we delve into GenAI, aligning them with the concepts presented in the taxonomy. We explore multi-modality, which involves fusing various types of data sources to expand the capabilities of GPAIS. Through the proposed definition and taxonomy, our aim is to facilitate research collaboration across different areas that are tackling general purpose tasks, as they share many common aspects. Finally, we discuss the state of GPAIS, prospects, societal implications, and the need for regulation and governance.

Decision Trees (DTs) are commonly used for many machine learning tasks due to their high degree of interpretability. However, learning a DT from data is a difficult optimization problem, as it is non-convex and non-differentiable. Therefore, common approaches learn DTs using a greedy growth algorithm that minimizes the impurity locally at each internal node. Unfortunately, this greedy procedure can lead to inaccurate trees. In this paper, we present a novel approach for learning hard, axis-aligned DTs with gradient descent. The proposed method uses backpropagation with a straight-through operator on a dense DT representation, to jointly optimize all tree parameters. Our approach outperforms existing methods on binary classification benchmarks and achieves competitive results for multi-class tasks. The method is available under: https://github.com/s-marton/GradTree

We show how to "compile" human-readable programs into standard decoder-only transformer models. Our compiler, Tracr, generates models with known structure. This structure can be used to design experiments. For example, we use it to study "superposition" in transformers that execute multi-step algorithms. Additionally, the known structure of Tracr-compiled models can serve as ground-truth for evaluating interpretability methods. Commonly, because the "programs" learned by transformers are unknown it is unclear whether an interpretation succeeded. We demonstrate our approach by implementing and examining programs including computing token frequencies, sorting, and parenthesis checking. We provide an open-source implementation of Tracr at https://github.com/google-deepmind/tracr.

We consider the community recovery problem on a multilayer variant of the hypergraph stochastic block model (HSBM). Each layer is associated with an independent realization of a d-uniform HSBM on N vertices. Given the similarity matrix containing the aggregated number of hyperedges incident to each pair of vertices, the goal is to obtain a partition of the N vertices into disjoint communities. In this work, we investigate a semidefinite programming (SDP) approach and obtain information-theoretic conditions on the model parameters that guarantee exact recovery both in the assortative and the disassortative cases.

Graph Neural Networks (GNNs) have increasingly become an indispensable tool in learning from graph-structured data, catering to various applications including social network analysis, recommendation systems, etc. At the heart of these networks are the edges which are crucial in guiding GNN models' predictions. In many scenarios, these edges represent sensitive information, such as personal associations or financial dealings -- thus requiring privacy assurance. However, their contributions to GNN model predictions may in turn be exploited by the adversary to compromise their privacy. Motivated by these conflicting requirements, this paper investigates edge privacy in contexts where adversaries possess black-box GNN model access, restricted further by access controls, preventing direct insights into arbitrary node outputs. In this context, we introduce a series of privacy attacks grounded on the message-passing mechanism of GNNs. These strategies allow adversaries to deduce connections between two nodes not by directly analyzing the model's output for these pairs but by analyzing the output for nodes linked to them. Our evaluation with seven real-life datasets and four GNN architectures underlines a significant vulnerability: even in systems fortified with access control mechanisms, an adaptive adversary can decipher private connections between nodes, thereby revealing potentially sensitive relationships and compromising the confidentiality of the graph.

As a result, many tasks that one would traditionally attribute to being done by a human being are being performed by machine learning (ML) and artificial intelligence (AI) based models. Hence it is not surprising to see machine learning models being deployed in areas where historically, due to the nature of the tasks, it would require the involvement of a human, e.g., getting a loan/ receiving a bail judgment. Unfortunately, many of these state-of-the-art machine learning or artificial intelligence-based systems are so complex that we are unable to understand why they made such a decision. This lack of clarity contributes to such models being viewed as a black box whose content/logic is unknown. A natural consequence of the increasing involvement of machine learning models in decisionmaking processes is that these decisions either directly or indirectly impact individuals.

While a substantial amount of work has recently been devoted to enhance the performance of computational Authorship Identification (AId) systems, little to no attention has been paid to endowing AId systems with the ability to explain the reasons behind their predictions. This lacking substantially hinders the practical employment of AId methodologies, since the predictions returned by such systems are hardly useful unless they are supported with suitable explanations. In this paper, we explore the applicability of existing general-purpose eXplainable Artificial Intelligence (XAI) techniques to AId, with a special focus on explanations addressed to scholars working in cultural heritage. In particular, we assess the relative merits of three different types of XAI techniques (feature ranking, probing, factuals and counterfactual selection) on three different AId tasks (authorship attribution, authorship verification, same-authorship verification) by running experiments on real AId data. Our analysis shows that, while these techniques make important first steps towards explainable Authorship Identification, more work remains to be done in order to provide tools that can be profitably integrated in the workflows of scholars.

In recent years, tasks of machine learning ranging from image processing & audio/video analysis to natural language understanding have been transformed by deep learning. The data content in all these scenarios are expressed via Euclidean space. However, a considerable amount of application data is structured in non-Euclidean space and is expressed as graphs, e.g. dealing with complicated interactions & object interdependencies. Modelling physical systems, learning molecular signatures, identifying protein interactions and predicting diseases involve utilising a model that can adapt from graph data. Graph neural networks (GNNs), specified as artificial-neural models, employ message transmission between graph nodes to represent graph dependencies and are primarily used in the non-Euclidean domain. Variants of GNN like Graph Recurrent Networks (GRN), Graph Auto Encoder (GAE), Graph Convolution Networks (GCN), Graph Adversarial Methods & Graph Reinforcement learning have exhibited breakthrough productivity on a wide range of tasks, especially in the field of bioinformatics, in recent years as a result of the rapid collection of biological network data. Apart from presenting all existing GNN models, mathematical analysis and comparison of the variants of all types of GNN have been highlighted in this survey. Graph neural networks are investigated for their potential real-world applications in various fields, focusing on Bioinformatics. Furthermore, resources for evaluating graph neural network models and accessing open-source code & benchmark data sets are included. Ultimately, we provide some (seven) proposals for future research in this rapidly evolving domain. GNNs have the potential to be an excellent tool for solving a wide range of biological challenges in bioinformatics research, as they are best represented as connected complex graphs.

In the rapidly evolving landscape of Large Language Models (LLMs), introduction of well-defined and standardized evaluation methodologies remains a crucial challenge. This paper traces the historical trajectory of LLM evaluations, from the foundational questions posed by Alan Turing to the modern era of AI research. We categorize the evolution of LLMs into distinct periods, each characterized by its unique benchmarks and evaluation criteria. As LLMs increasingly mimic human-like behaviors, traditional evaluation proxies, such as the Turing test, have become less reliable. We emphasize the pressing need for a unified evaluation system, given the broader societal implications of these models. Through an analysis of common evaluation methodologies, we advocate for a qualitative shift in assessment approaches, underscoring the importance of standardization and objective criteria. This work serves as a call for the AI community to collaboratively address the challenges of LLM evaluation, ensuring their reliability, fairness, and societal benefit.