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Improved docking, screening and selectivity prediction for small molecule nuclear receptor modulators using conformational ensembles

Nuclear receptors (NRs) are ligand dependent transcriptional factors and play a key role in reproduction, development, and homeostasis of organism. NRs are potential targets for treatment of cancer and other diseases such as inflammatory diseases, and diabetes. In this study, we present a comprehens...

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Detalhes bibliográficos
Main Authors: Park, So-Jung, Kufareva, Irina, Abagyan, Ruben
Formato: Artigo
Idioma:Inglês
Publicado em: Springer Netherlands 2010
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC2881208/
https://ncbi.nlm.nih.gov/pubmed/20455005
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s10822-010-9362-4
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