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The creation and characterisation of a National Compound Collection: the Royal Society of Chemistry pilot

We present a summary of the National Compound Collection (NCC) pilot; which harvested chemical structure data from 746 publicly-available PhD theses to create an enhanced database of diverse and interesting (largely organic) molecular entities. The database comprised ∼75 000 structure entries, of wh...

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Detalles Bibliográficos
Autores principales: Andrews, David M., Broad, Laura M., Edwards, Paul J., Fox, David N. A., Gallagher, Timothy, Garland, Stephen L., Kidd, Richard, Sweeney, Joseph B.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Royal Society of Chemistry 2016
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6013800/
https://www.ncbi.nlm.nih.gov/pubmed/30155031
http://dx.doi.org/10.1039/c6sc00264a