quemb.molbe.graphfrag.GraphGenUtility

class quemb.molbe.graphfrag.GraphGenUtility

Utility functions for handling graphs in graphgen().

Methods

__init__()

Method generated by attrs for class GraphGenUtility.

export_graph(edge_list, adx_map, ...[, ...])

Export a visual representation of a fragment-based adjacency graph to a PNG.

get_subgraphs(motifs_per_frag, edge_list, ...)

Construct labeled subgraphs for fragments using motif, edge, and label data.