Computing maximal cliques in link streams

A link stream is a collection of triplets $(t, u, v)$ indicating that an interaction occurred between u and v at time t. We generalize the classical notion of cliques in graphs to such link streams: for a given $\Delta$, a $\Delta$-clique is a set of nodes and a time interval such that all pairs of nodes in this set interact at least once during each sub-interval of duration $\Delta$. We propose an algorithm to enumerate all maximal (in terms of nodes or time interval) cliques of a link stream, and illustrate its practical relevance on a real-world contact trace

Subgraph Matching Kernels for Attributed Graphs

We propose graph kernels based on subgraph matchings, i.e. structure-preserving bijections between subgraphs. While recently proposed kernels based on common subgraphs (Wale et al., 2008; Shervashidze et al., 2009) in general can not be applied to attributed graphs, our approach allows to rate mappings of subgraphs by a flexible scoring scheme comparing vertex and edge attributes by kernels. We show that subgraph matching kernels generalize several known kernels. To compute the kernel we propose a graph-theoretical algorithm inspired by a classical relation between common subgraphs of two graphs and cliques in their product graph observed by Levi (1973). Encouraging experimental results on a classification task of real-world graphs are presented.Comment: Appears in Proceedings of the 29th International Conference on Machine Learning (ICML 2012

Shadoks Approach to Convex Covering

We describe the heuristics used by the Shadoks team in the CG:SHOP 2023 Challenge. The Challenge consists of 206 instances, each being a polygon with holes. The goal is to cover each instance polygon with a small number of convex polygons. Our general strategy is the following. We find a big collection of large (often maximal) convex polygons inside the instance polygon and then solve several set cover problems to find a small subset of the collection that covers the whole polygon.Comment: SoCG CG:SHOP 2023 Challeng

Communicability Graph and Community Structures in Complex Networks

We use the concept of the network communicability (Phys. Rev. E 77 (2008) 036111) to define communities in a complex network. The communities are defined as the cliques of a communicability graph, which has the same set of nodes as the complex network and links determined by the communicability function. Then, the problem of finding the network communities is transformed to an all-clique problem of the communicability graph. We discuss the efficiency of this algorithm of community detection. In addition, we extend here the concept of the communicability to account for the strength of the interactions between the nodes by using the concept of inverse temperature of the network. Finally, we develop an algorithm to manage the different degrees of overlapping between the communities in a complex network. We then analyze the USA airport network, for which we successfully detect two big communities of the eastern airports and of the western/central airports as well as two bridging central communities. In striking contrast, a well-known algorithm groups all but two of the continental airports into one community.Comment: 36 pages, 5 figures, to appear in Applied Mathematics and Computatio

Shared-Memory Parallel Maximal Clique Enumeration

We present shared-memory parallel methods for Maximal Clique Enumeration (MCE) from a graph. MCE is a fundamental and well-studied graph analytics task, and is a widely used primitive for identifying dense structures in a graph. Due to its computationally intensive nature, parallel methods are imperative for dealing with large graphs. However, surprisingly, there do not yet exist scalable and parallel methods for MCE on a shared-memory parallel machine. In this work, we present efficient shared-memory parallel algorithms for MCE, with the following properties: (1) the parallel algorithms are provably work-efficient relative to a state-of-the-art sequential algorithm (2) the algorithms have a provably small parallel depth, showing that they can scale to a large number of processors, and (3) our implementations on a multicore machine shows a good speedup and scaling behavior with increasing number of cores, and are substantially faster than prior shared-memory parallel algorithms for MCE.Comment: 10 pages, 3 figures, proceedings of the 25th IEEE International Conference on. High Performance Computing, Data, and Analytics (HiPC), 201

Listing all maximal cliques in sparse graphs in near-optimal time

The degeneracy of an $n$-vertex graph $G$ is the smallest number $d$ such that every subgraph of $G$ contains a vertex of degree at most $d$. We show that there exists a nearly-optimal fixed-parameter tractable algorithm for enumerating all maximal cliques, parametrized by degeneracy. To achieve this result, we modify the classic Bron--Kerbosch algorithm and show that it runs in time $O(dn3^{d/3})$. We also provide matching upper and lower bounds showing that the largest possible number of maximal cliques in an $n$-vertex graph with degeneracy $d$ (when $d$ is a multiple of 3 and $nge d+3$) is $(n-d)3^{d/3}$. Therefore, our algorithm matches the $Theta(d(n-d)3^{d/3})$ worst-case output size of the problem whenever $n-d=Omega(n)$

Maximum Common Subgraph Isomorphism Algorithms

Maximum common subgraph (MCS) isomorphism algorithms play an important role in chemoinformatics by providing an effective mechanism for the alignment of pairs of chemical structures. This article discusses the various types of MCS that can be identified when two graphs are compared and reviews some of the algorithms that are available for this purpose, focusing on those that are, or may be, applicable to the matching of chemical graphs

A maximum common substructure-based algorithm for searching and predicting drug-like compounds

Motivation: The prediction of biologically active compounds is of great importance for high-throughput screening (HTS) approaches in drug discovery and chemical genomics. Many computational methods in this area focus on measuring the structural similarities between chemical structures. However, traditional similarity measures are often too rigid or consider only global similarities between structures. The maximum common substructure (MCS) approach provides a more promising and flexible alternative for predicting bioactive compounds