Graph Filtration Kernels
نویسندگان
چکیده
The majority of popular graph kernels is based on the concept Haussler's R-convolution kernel and defines similarities in terms mutual substructures. In this work, we enrich these similarity measures by considering filtrations: Using meaningful orders set edges, which allow to construct a sequence nested graphs, can consider at multiple granularities. A key our approach track features over course such resolutions. Rather than simply compare frequencies allows for their comparison when how long they exist sequences. propose family that incorporate existence intervals features. While be applied arbitrary features, particularly highlight Weisfeiler-Lehman vertex labels, leading efficient kernels. We show using labels certain filtrations strictly increases expressive power ordinary procedure deciding isomorphism. fact, result directly yields more powerful has implications neural networks due close relationship method. empirically validate significant improvements state-of-the-art predictive performance various real-world benchmark datasets.
منابع مشابه
Graph Kernels for Chemoinformatics
In chemoinformatics and bioinformatics, it is effective to automatically predict the properties of chemical compounds and proteins with computeraided methods, since this can substantially reduce the costs of research and development by screening out unlikely compounds and proteins from the candidates for ‘wet” experiment. Data-driven predictive modeling is one of the main research topics in che...
متن کاملInformation theoretic graph kernels
This thesis addresses the problems that arise in state-of-the-art structural learning methods for (hyper)graph classification or clustering, particularly focusing on developing novel information theoretic kernels for graphs. To this end, we commence in Chapter 3 by defining a family of Jensen-Shannon diffusion kernels, i.e., the information theoretic kernels, for (un)attributed graphs. We show ...
متن کاملGraph Invariant Kernels
We introduce a novel kernel that upgrades the Weisfeiler-Lehman and other graph kernels to effectively exploit highdimensional and continuous vertex attributes. Graphs are first decomposed into subgraphs. Vertices of the subgraphs are then compared by a kernel that combines the similarity of their labels and the similarity of their structural role, using a suitable vertex invariant. By changing...
متن کاملWeisfeiler-Lehman Graph Kernels
In this article, we propose a family of efficient kernels for large graphs with discrete node labels. Key to our method is a rapid feature extraction scheme based on the Weisfeiler-Lehman test of isomorphism on graphs. It maps the original graph to a sequence of graphs, whose node attributes capture topological and label information. A family of kernels can be defined based on this Weisfeiler-L...
متن کاملذخیره در منابع من
با ذخیره ی این منبع در منابع من، دسترسی به آن را برای استفاده های بعدی آسان تر کنید
ژورنال
عنوان ژورنال: Proceedings of the ... AAAI Conference on Artificial Intelligence
سال: 2022
ISSN: ['2159-5399', '2374-3468']
DOI: https://doi.org/10.1609/aaai.v36i8.20793