“Molecular Anatomy”: a new multi-dimensional hierarchical scaffold analysis tool

The scaffold representation is widely employed to classify bioactive compounds on the basis of common core structures or correlate compound classes with specific biological activities. In this paper, we present a novel approach called “Molecular Anatomy” as a flexible and unbiased molecular scaffold...

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Detalles Bibliográficos
Autores principales: Manelfi, Candida, Gemei, Marica, Talarico, Carmine, Cerchia, Carmen, Fava, Anna, Lunghini, Filippo, Beccari, Andrea Rosario
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2021
Materias:
Research Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8299179/
https://www.ncbi.nlm.nih.gov/pubmed/34301327
http://dx.doi.org/10.1186/s13321-021-00526-y

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8299179/
https://www.ncbi.nlm.nih.gov/pubmed/34301327
http://dx.doi.org/10.1186/s13321-021-00526-y

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