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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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Sonraí Bibleagrafaíochta
Main Authors: Park, So-Jung, Kufareva, Irina, Abagyan, Ruben
Formáid: Artigo
Teanga:Inglês
Foilsithe: Springer Netherlands 2010
Ábhair:
Rochtain Ar Líne: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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