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Quantifying structure and performance diversity for sets of small molecules comprising small-molecule screening collections

Using a diverse collection of small molecules we recently found that compound sets from different sources (commercial; academic; natural) have different protein-binding behaviors, and these behaviors correlate with trends in stereochemical complexity for these compound sets. These results lend insig...

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Detalhes bibliográficos
Main Authors: Clemons, Paul A., Wilson, J. Anthony, Dančík, Vlado, Muller, Sandrine, Carrinski, Hyman A., Wagner, Bridget K., Koehler, Angela N., Schreiber, Stuart L.
Formato: Artigo
Idioma:Inglês
Publicado em: National Academy of Sciences 2011
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3084049/
https://ncbi.nlm.nih.gov/pubmed/21482810
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.1015024108
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