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Extended similarity indices: the benefits of comparing more than two objects simultaneously. Part 1: Theory and characteristics(†)
Quantification of the similarity of objects is a key concept in many areas of computational science. This includes cheminformatics, where molecular similarity is usually quantified based on binary fingerprints. While there is a wide selection of available molecular representations and similarity met...
Autores principales: | Miranda-Quintana, Ramón Alain, Bajusz, Dávid, Rácz, Anita, Héberger, Károly |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Springer International Publishing
2021
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8067658/ https://www.ncbi.nlm.nih.gov/pubmed/33892802 http://dx.doi.org/10.1186/s13321-021-00505-3 |
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