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We introduce in this paper the mechanism of graph random features (GRFs). GRFs can be used to construct unbiased randomized estimators of several important kernels defined on graphs' nodes, in particular the regularized Laplacian kernel. As…

Machine Learning · Computer Science 2023-05-02 Krzysztof Choromanski

Neutral atom arrays have emerged as a versatile candidate for the embedding of hard classical optimization problems. Prior work has focused on mapping problems onto finding the maximum independent set of weighted or unweighted unit disk…

Quantum Physics · Physics 2026-03-02 Toonyawat Angkhanawin , Aydin Deger , Jonathan D. Pritchard , C. Stuart Adams

Quantum simulators have the potential to solve quantum many-body problems that are beyond the reach of classical computers, especially when they feature long-range entanglement. To fulfill their prospects, quantum simulators must be fully…

Graph kernels are often used in bioinformatics and network applications to measure the similarity between graphs; therefore, they may be used to construct efficient graph classifiers. Many graph kernels have been developed thus far, but to…

Quantum Physics · Physics 2022-11-01 Kaito Kishi , Takahiko Satoh , Rudy Raymond , Naoki Yamamoto , Yasubumi Sakakibara

Node embeddings map graph vertices into low-dimensional Euclidean spaces while preserving structural information. They are central to tasks such as node classification, link prediction, and signal reconstruction. A key goal is to design…

Machine Learning · Computer Science 2026-02-18 Valentin de Bassompierre , Jean-Charles Delvenne , Laurent Jacques

We propose digital-analog quantum kernels for enhancing the detection of complex features in the classification of images. We consider multipartite-entangled analog blocks, stemming from native Ising interactions in neutral-atom quantum…

We propose a novel random walk-based algorithm for unbiased estimation of arbitrary functions of a weighted adjacency matrix, coined universal graph random features (u-GRFs). This includes many of the most popular examples of kernels…

Machine Learning · Statistics 2024-05-27 Isaac Reid , Krzysztof Choromanski , Eli Berger , Adrian Weller

In this paper, we propose a novel graph kernel, namely the Quantum-based Entropic Subtree Kernel (QESK), for Graph Classification. To this end, we commence by computing the Average Mixing Matrix (AMM) of the Continuous-time Quantum Walk…

Machine Learning · Computer Science 2022-12-13 Lu Bai , Lixin Cui , Edwin R. Hancock

Graphs effectively characterize relational data, driving graph representation learning methods that uncover underlying predictive information. As state-of-the-art approaches, Graph Neural Networks (GNNs) enable end-to-end learning for…

Machine Learning · Computer Science 2025-04-24 Mao Wang , Tao Wu , Xingping Xian , Shaojie Qiao , Weina Niu , Canyixing Cui

We investigate the classical reducibility of random unit-disk graph (UDG) instances of the maximum independent set (MIS) and maximum weighted independent set (MWIS) problems, which can be natively realised in Rydberg atom quantum…

Quantum Physics · Physics 2026-05-11 J. Kombe , J. D. Pritchard

We introduce a novel class of explicit feature maps based on topological indices that represent each graph by a compact feature vector, enabling fast and interpretable graph classification. Using radial basis function kernels on these…

Machine Learning · Computer Science 2025-09-23 Adam Wesołowski , Ronin Wu , Karim Essafi

In this work, we develop an Aligned Entropic Reproducing Kernel (AERK) for graph classification. We commence by performing the Continuous-time Quantum Walk (CTQW) on each graph structure, and computing the Averaged Mixing Matrix (AMM) to…

Machine Learning · Computer Science 2023-03-08 Lixin Cui , Ming Li , Yue Wang , Lu Bai , Edwin R. Hancock

Neutral atom technology has steadily demonstrated significant theoretical and experimental advancements, positioning itself as a front-runner platform for running quantum algorithms. One unique advantage of this technology lies in the…

Neutral atom arrays have emerged as a versatile platform towards scalable quantum computation and optimization. In this paper we present demonstrations of solving maximum weighted independent set problems on a Rydberg atom array using…

Graph embedding is a recurrent problem in quantum computing, for instance, quantum annealers need to solve a minor graph embedding in order to map a given Quadratic Unconstrained Binary Optimization (QUBO) problem onto their internal…

Quantum kernels quantify similarity between data points by measuring the inner product between quantum states, computed through quantum circuit measurements. By embedding data into quantum systems, quantum kernel feature maps, that may be…

Quantum Physics · Physics 2025-03-24 Joachim Tomasi , Sandrine Anthoine , Hachem Kadri

We introduce a family of multilayer graph kernels and establish new links between graph convolutional neural networks and kernel methods. Our approach generalizes convolutional kernel networks to graph-structured data, by representing…

Machine Learning · Statistics 2020-06-30 Dexiong Chen , Laurent Jacob , Julien Mairal

In this paper, we develop a new graph kernel, namely the Hierarchical Transitive-Aligned kernel, by transitively aligning the vertices between graphs through a family of hierarchical prototype graphs. Comparing to most existing…

Social and Information Networks · Computer Science 2020-02-12 Lu Bai , Lixin Cui , Edwin R. Hancock

We introduce Quantum Graph Attention Networks (QGATs) as trainable quantum encoders for inductive learning on graphs, extending the Quantum Graph Neural Networks (QGNN) framework. QGATs leverage parameterized quantum circuits to encode node…

Quantum Physics · Physics 2025-09-16 Arthur M. Faria , Mehdi Djellabi , Igor O. Sokolov , Savvas Varsamopoulos

Graph kernels are kernel methods measuring graph similarity and serve as a standard tool for graph classification. However, the use of kernel methods for node classification, which is a related problem to graph representation learning, is…

Machine Learning · Computer Science 2019-10-08 Yu Tian , Long Zhao , Xi Peng , Dimitris N. Metaxas