XJTU-ICP / FullereneDataParser

MIT License
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Dev fullerene algorithm #10

Closed saltball closed 3 years ago

saltball commented 3 years ago

Establish the initiate version for finding cycles with boost::graph using cython. package fullerenedatapraser.graph.algorithm now have module dual with class py_graph_circle_finder for a cycle finder instance, in which function get_face_vertex_list will return a list of numpy.array consist of all circle vertex index. Warning: no error except for non-planarity graph and check. It will be an undefined behavior.