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A Structural Hierarchy Matching Approach for Molecular Similarity/Substructure Searching
An approach for molecular similarity/substructure searching based on structural hierarchy matching is proposed. In this approach, small molecules are divided into two categories, acyclic and cyclic forms. The latter are further divided into three structural hierarchies, namely, framework, complicate...
| Autores principales: | , , , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
MDPI
2015
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6272706/ https://www.ncbi.nlm.nih.gov/pubmed/25988610 http://dx.doi.org/10.3390/molecules20058791 |