File:Breadth-first search generation - journal.pcbi.1008504.g002.png

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Breadth-first search generation

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Description
English: Breadth-first search generation. Molecular structure generation is explained step by step. Starting from a set of atoms, bonds are added between atom pairs until reaching saturated structures.
Date
Source Yirik MA, Steinbeck C (2021) Chemical graph generators. PLoS Comput Biol 17(1): e1008504. https://doi.org/10.1371/journal.pcbi.1008504
Author Mehmet Aziz Yirik, Christoph Steinbeck
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