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Graph-structured data are an integral part of many application domains, including chemoinformatics, computational biology, neuroimaging, and social network analysis. Over the last two decades, numerous graph kernels, i.e. kernel functions…

Machine Learning · Computer Science 2021-03-10 Karsten Borgwardt , Elisabetta Ghisu , Felipe Llinares-López , Leslie O'Bray , Bastian Rieck

Graph kernels have been successfully applied to many graph classification problems. Typically, a kernel is first designed, and then an SVM classifier is trained based on the features defined implicitly by this kernel. This two-stage…

We present novel graph kernels for graphs with node and edge labels that have ordered neighborhoods, i.e. when neighbor nodes follow an order. Graphs with ordered neighborhoods are a natural data representation for evolving graphs where…

Machine Learning · Computer Science 2018-05-30 Moez Draief , Konstantin Kutzkov , Kevin Scaman , Milan Vojnovic

We introduce propagation kernels, a general graph-kernel framework for efficiently measuring the similarity of structured data. Propagation kernels are based on monitoring how information spreads through a set of given graphs. They leverage…

Machine Learning · Statistics 2014-10-14 Marion Neumann , Roman Garnett , Christian Bauckhage , Kristian Kersting

We propose a new graph-theoretic benchmark in this paper. The benchmark is developed to address shortcomings of an existing widely-used graph benchmark. We thoroughly studied a large number of traditional and contemporary graph algorithms…

Performance · Computer Science 2010-05-06 Andy B. Yoo , Yang Liu , Sheila Vaidya , Stephen Poole

We introduce two novel complementary notions of the Lefschetz number for a functor from a finite acyclic category to itself and we prove a Lefschetz fixed-object theorem and a Lefschetz fixed-morphism theorem. In order to do so, we use the…

Algebraic Topology · Mathematics 2024-04-11 Samuel Castelo-Mourelle , Enrique Macías-Virgós , David Mosquera-Lois

Provenance is a record that describes how entities, activities, and agents have influenced a piece of data; it is commonly represented as graphs with relevant labels on both their nodes and edges. With the growing adoption of provenance in…

Machine Learning · Computer Science 2021-09-16 David Kohan Marzagão , Trung Dong Huynh , Ayah Helal , Sean Baccas , Luc Moreau

We prove two general decomposition theorems for fixed-point invariants: one for the Lefschetz number and one for the Reidemeister trace. These theorems imply the familiar additivity results for these invariants. Moreover, the proofs of…

Algebraic Topology · Mathematics 2017-09-28 Kate Ponto , Michael Shulman

We introduce a convolutional neural network that operates directly on graphs. These networks allow end-to-end learning of prediction pipelines whose inputs are graphs of arbitrary size and shape. The architecture we present generalizes…

We propose a new graph kernel for graph classification and comparison using Ollivier Ricci curvature. The Ricci curvature of an edge in a graph describes the connectivity in the local neighborhood. An edge in a densely connected…

Machine Learning · Computer Science 2019-07-17 Kin Sum Liu , Chien-Chun Ni , Yu-Yao Lin , Jie Gao

The success of kernel methods has initiated the design of novel positive semidefinite functions, in particular for structured data. A leading design paradigm for this is the convolution kernel, which decomposes structured objects into their…

Machine Learning · Computer Science 2017-02-01 Nils M. Kriege , Pierre-Louis Giscard , Richard C. Wilson

We obtain an equivariant index theorem, or Lefschetz fixed-point formula, for isometries from complete Riemannian manifolds to themselves. The fixed-point set of such an isometry may be noncompact. We build on techniques developed by Roe.…

Differential Geometry · Mathematics 2024-01-10 Peter Hochs

Graph neural networks (GNNs) are a powerful tool to learn representations on graphs by iteratively aggregating features from node neighbourhoods. Many variant models have been proposed, but there is limited understanding on both how to…

Machine Learning · Computer Science 2019-11-14 Michael Lingzhi Li , Meng Dong , Jiawei Zhou , Alexander M. Rush

In a directed graph, a kernel is a subset of vertices that is both stable and absorbing. Not all digraphs have a kernel, but a theorem due to Boros and Gurvich guarantees the existence of a kernel in every clique-acyclic orientation of a…

Discrete Mathematics · Computer Science 2018-01-09 Adèle Pass-Lanneau , Ayumi Igarashi , Frédéric Meunier

Many real world graphs, such as the graphs of molecules, exhibit structure at multiple different scales, but most existing kernels between graphs are either purely local or purely global in character. In contrast, by building a hierarchy of…

Machine Learning · Statistics 2016-05-31 Risi Kondor , Horace Pan

We prove two general factorization theorems for fixed-point invariants of fibrations: one for the Lefschetz number and one for the Reidemeister trace. These theorems imply the familiar multiplicativity results for the Lefschetz and Nielsen…

Algebraic Topology · Mathematics 2014-10-01 Kate Ponto , Michael Shulman

Graph kernels methods are based on an implicit embedding of graphs within a vector space of large dimension. This implicit embedding allows to apply to graphs methods which where until recently solely reserved to numerical data. Within the…

Computer Vision and Pattern Recognition · Computer Science 2008-10-21 François-Xavier Dupé , Luc Brun

We examine the localizing subcategories of the derived category of quasi-coherent sheaves on the projective line over a field. We provide a complete classification of all such subcategories which arise as the kernel of a cohomological…

Category Theory · Mathematics 2017-09-07 Henning Krause , Greg Stevenson

We present a unified framework to study graph kernels, special cases of which include the random walk graph kernel \citep{GaeFlaWro03,BorOngSchVisetal05}, marginalized graph kernel \citep{KasTsuIno03,KasTsuIno04,MahUedAkuPeretal04}, and…

Machine Learning · Computer Science 2010-11-30 S. V. N. Vishwanathan , Karsten M. Borgwardt , Imre Risi Kondor , Nicol N. Schraudolph

Constructing the adjacency graph is fundamental to graph-based clustering. Graph learning in kernel space has shown impressive performance on a number of benchmark data sets. However, its performance is largely determined by the chosen…

Machine Learning · Computer Science 2019-03-15 Zhao Kang , Liangjian Wen , Wenyu Chen , Zenglin Xu