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Tracing compound pathways using chemical space networks

Similarity-based compound networks are used as coordinate-free representations of chemical space. In so-called chemical space networks (CSNs), nodes represent compounds and edges pairwise similarity relationships. Nodes can be annotated with activity information, which enables visualization of struc...

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Detalhes bibliográficos
Publicado no:Medchemcomm
Main Authors: Kunimoto, Ryo, Vogt, Martin, Bajorath, Jürgen
Formato: Artigo
Idioma:Inglês
Publicado em: Royal Society of Chemistry 2016
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6072420/
https://ncbi.nlm.nih.gov/pubmed/30108753
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c6md00628k
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