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Asymmetric Clustering Index in a Case Study of 5-HT(1A) Receptor Ligands
The automatic clustering of chemical compounds is an important branch of chemoinformatics. In this paper the Asymmetric Clustering Index (Aci) is proposed to assess how well an automatically created partition reflects the reference. The asymmetry allows for a distinction between the fixed reference...
| Autores principales: | , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Public Library of Science
2014
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4096758/ https://www.ncbi.nlm.nih.gov/pubmed/25019251 http://dx.doi.org/10.1371/journal.pone.0102069 |