Improving graphs of cycles approach to structural similarity of molecules

This paper focuses on determining the structural similarity of two molecules, i.e., the similarity of the interconnection of all the elementary cycles in the corresponding molecular graphs. In this paper, we propose and analyze an algorithmic approach based on the resolution of the Maximum Common Ed...

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Detalles Bibliográficos
Autores principales: Nouleho Ilemo, Stefi, Barth, Dominique, David, Olivier, Quessette, Franck, Weisser, Marc-Antoine, Watel, Dimitri
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Public Library of Science 2019
Materias:
Research Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6934298/
https://www.ncbi.nlm.nih.gov/pubmed/31881046
http://dx.doi.org/10.1371/journal.pone.0226680

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6934298/
https://www.ncbi.nlm.nih.gov/pubmed/31881046
http://dx.doi.org/10.1371/journal.pone.0226680

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