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Maximum common property: a new approach for molecular similarity
The maximum common property similarity (MCPhd) method is presented using descriptors as a new approach to determine the similarity between two chemical compounds or molecular graphs. This method uses the concept of maximum common property arising from the concept of maximum common substructure and i...
Autores principales: | Antelo-Collado, Aurelio, Carrasco-Velar, Ramón, García-Pedrajas, Nicolás, Cerruela-García, Gonzalo |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Springer International Publishing
2020
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7547443/ https://www.ncbi.nlm.nih.gov/pubmed/33372638 http://dx.doi.org/10.1186/s13321-020-00462-3 |
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