Related papers: Algebraic Combinatorics in Mathematical Chemistry.…

Let $G$ be a simple graph with adjacency matrix $A(G)$, signless Laplacian matrix $Q(G)$, degree diagonal matrix $D(G)$ and let $l(G)$ be the line graph of $G$. In 2017, Nikiforov defined the $A_\alpha$-matrix of $G$, $A_\alpha(G)$, as a…

Laplacian matrices of graphs arise in large-scale computational applications such as machine learning; spectral clustering of images, genetic data and web pages; transportation network flows; electrical resistor circuits; and elliptic…

We propose a scalable Gromov-Wasserstein learning (S-GWL) method and establish a novel and theoretically-supported paradigm for large-scale graph analysis. The proposed method is based on the fact that Gromov-Wasserstein discrepancy is a…

For a fixed integer $n$, let $G_n$ be the graph whose vertices are the partitions of $n$, with adjacency defined by a single elementary transfer of a cell in the Ferrers diagram. In a previous paper, the clique complex $K_n =…

For any connected complex reductive group $G$ and element $z$ of its Weyl group $W$, we use work of Lusztig and Abreu-Nigro to compute the graded $W$-character of the intersection cohomology of any closed Lusztig variety for $z$ over the…

We review quantum chaos on graphs. We construct a unitary operator which represents the quantum evolution on the graph and study its spectral and wavefunction statistics. This operator is the analogue of the classical evolution operator on…

The paper studies wsat$(G,H)$ which is the minimum number of edges in a weakly $H$-saturated subgraph of $G$. We prove that wsat$(K_n,H)$ is `stable' - remains the same after independent removal of every edge of $K_n$ with constant…

A vertex set $X$ of a graph $G$ is an association set if each component of $G - X$ is a clique, or a dissociation set if each component of $G - X$ is a single vertex or a single edge. Interestingly, $G - X$ is then precisely a graph…

We introduce the $\star_G$ tensor algebra, in which any finite group $G$ defines the multiplication rule, making equivariance an intrinsic algebraic property rather than an architectural constraint. The framework rests on three…

The $k$-token graph $F_k(G)$ of a graph $G$ is the graph whose vertices are the $k$-subsets of vertices from $G$, two of which being adjacent whenever their symmetric difference is a pair of adjacent vertices in $G$. In this article, we…

We prove that the number of iterations taken by the Weisfeiler-Leman algorithm for configurations coming from Schreier graphs is closely linked to the diameter of the graphs themselves: an upper bound is found for general Schreier graphs,…

For a given graph $\mathcal{G}$ of order $n$ with $m$ edges, and a real symmetric matrix associated to the graph, $M\left(\mathcal{G}\right)\in\mathbb{R}^{n\times n}$, the interlacing graph reduction problem is to find a graph…

To be able to predict a molecular graph structure ($W$) given a 2D image of a chemical compound ($U$) is a challenging problem in machine learning. We are interested to learn $f: U \rightarrow W$ where we have a fully mediating…

We introduce a simple procedure to integrate differential forms with arbitrary holomorphic poles on Riemann surfaces. It gives rise to an intrinsic regularization of such singular integrals in terms of the underlying conformal geometry.…

Graph is an usual representation of relational data, which are ubiquitous in manydomains such as molecules, biological and social networks. A popular approach to learningwith graph structured data is to make use of graph kernels, which…

Current GNN architectures use a vertex neighborhood aggregation scheme, which limits their discriminative power to that of the 1-dimensional Weisfeiler-Lehman (WL) graph isomorphism test. Here, we propose a novel graph convolution operator…

A reassembling of a simple graph G = (V,E) is an abstraction of a problem arising in earlier studies of network analysis. There are several equivalent definitions of graph reassembling; in this report we use a definition which makes it…

Consider a random graph $G$ of size $N$ constructed according to a \textit{graphon} $w \, : \, [0,1]^{2} \mapsto [0,1]$ as follows. First embed $N$ vertices $V = \{v_1, v_2, \ldots, v_N\}$ into the interval $[0,1]$, then for each $i < j$…

Most state-of-the-art graph kernels only take local graph properties into account, i.e., the kernel is computed with regard to properties of the neighborhood of vertices or other small substructures. On the other hand, kernels that do take…

A dominating set of a graph $G$ is a set $D\subseteq V_G$ such that every vertex in $V_G-D$ is adjacent to at least one vertex in $D$, and the domination number $\gamma(G)$ of $G$ is the minimum cardinality of a dominating set of $G$. A set…