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Efficient enumeration of monocyclic chemical graphs with given path frequencies
BACKGROUND: The enumeration of chemical graphs (molecular graphs) satisfying given constraints is one of the fundamental problems in chemoinformatics and bioinformatics because it leads to a variety of useful applications including structure determination and development of novel chemical compounds....
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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BioMed Central
2014
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4049473/ https://www.ncbi.nlm.nih.gov/pubmed/24955135 http://dx.doi.org/10.1186/1758-2946-6-31 |