In graph theory, a partial cube is a graph that is an isometric subgraph of a hypercube. In other words, a partial cube is a subgraph of a hypercube that preserves distances—the distance between any two vertices in the subgraph is the same as the distance between those vertices in the hypercube. Equivalently, a partial cube is a graph whose vertices can be labeled with bit strings of equal length in such a way that the distance between two vertices in the graph is equal to the Hamming distance between their labels. Such a labeling is called a Hamming labeling; it represents an isometric embedding of the partial cube into a hypercube.
Firsov (1965) was the first to study isometric embeddings of graphs into hypercubes. The graphs that admit such embeddings were characterized by Djoković (1973) and Winkler (1984), and were later named partial cubes. A separate line of research on the same structures, in the terminology of families of sets rather than of hypercube labelings of graphs, was followed by Kuzmin & Ovchinnikov (1975) and Falmagne & Doignon (1997), among others.
The Desargues graph is a partial cube, as is more generally any bipartite Kneser graph H2n+1,n. In this bipartite Kneser graph, the labels consist of all possible (2n + 1)-digit bitstrings that have either n or n + 1 nonzero bits; the Desargues graph is constructed in this way with n = 2.
All median graphs are partial cubes. Since the median graphs include the squaregraphs, simplex graphs, and Fibonacci cubes, as well as the covering graphs of finite distributive lattices, these are all partial cubes. The planar dual graph of an arrangement of lines in the Euclidean plane, is a partial cube; more generally, for any hyperplane arrangement in Euclidean space of any number of dimensions, the graph that has a vertex for each cell of the arrangement and an edge for each two adjacent cells is a partial cube.
A partial cube in which every vertex has exactly three neighbors is known as a cubic partial cube. Although several infinite families of cubic partial cubes are known, together with many other sporadic examples, the only known cubic partial cube that is not a planar graph is the Desargues graph.
The underlying graph of any antimatroid, having a vertex for each set in the antimatroid and an edge for every two sets that differ by a single element, is always a partial cube.
The Djoković–Winkler relation
Many of the theorems about partial cubes are based directly or indirectly upon a certain binary relation defined on the edges of the graph. This relation, first described by Djoković (1973) and given an equivalent definition in terms of distances by Winkler (1984), is denoted by . Two edges and are defined to be in the relation , written , if . This relation is reflexive and symmetric, but in general it is not transitive.
Winkler showed that a connected graph is a partial cube if and only if it is bipartite and the relation is transitive. In this case, it forms an equivalence relation and each equivalence class separates two connected subgraphs of the graph from each other. A Hamming labeling may be obtained by assigning one bit of each label to each of the equivalence classes of the Djoković–Winkler relation; in one of the two connected subgraphs separated by an equivalence class of edges, all of the vertices have a 0 in that position of their labels, and in the other connected subgraph all of the vertices have a 1 in the same position.
Partial cubes can be recognized, and a Hamming labeling constructed, in time, where is the number of vertices in the graph. Given a partial cube, it is straightforward to construct the equivalence classes of the Djoković–Winkler relation by doing a breadth first search from each vertex, in total time ; the -time recognition algorithm speeds this up by using bit-level parallelism to perform multiple breadth first searches in a single pass through the graph, and then applies a separate algorithm to verify that the result of this computation is a valid partial cube labeling.
The isometric dimension of a partial cube is the minimum dimension of a hypercube onto which it may be isometrically embedded, and is equal to the number of equivalence classes of the Djoković–Winkler relation. For instance, the isometric dimension of an -vertex tree is its number of edges, . An embedding of a partial cube onto a hypercube of this dimension is unique, up to symmetries of the hypercube.
Every hypercube and therefore every partial cube may be embedded isometrically into an integer lattice, and the lattice dimension of the partial cube is the minimum dimension of an integer lattice for which this is possible. The lattice dimension may be significantly smaller than the isometric dimension; for instance, for a tree it is half the number of leaves in the tree (rounded up to the nearest integer). The lattice dimension of any graph, and a lattice embedding of minimum dimension, may be found in polynomial time by an algorithm based on maximum matching in an auxiliary graph.
Other types of dimension of partial cubes have also been defined, based on embeddings into more specialized structures.
Application to chemical graph theory
Isometric embeddings of graphs into hypercubes have an important application in chemical graph theory. A benzenoid graph is a graph consisting of all vertices and edges lying on and in the interior of a cycle in a hexagonal lattice. Such graphs are the molecular graphs of the benzenoid hydrocarbons, a large class of organic molecules. Every such graph is a partial cube. A Hamming labeling of such a graph can be used to compute the Wiener index of the corresponding molecule, which can then be used to predict certain of its chemical properties.
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