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Scaffold-Focused Virtual Screening: Prospective Application to the Discovery of TTK Inhibitors
[Image: see text] We describe and apply a scaffold-focused virtual screen based upon scaffold trees to the mitotic kinase TTK (MPS1). Using level 1 of the scaffold tree, we perform both 2D and 3D similarity searches between a query scaffold and a level 1 scaffold library derived from a 2 million com...
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| Główni autorzy: | , , , , |
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| Format: | Artigo |
| Język: | Inglês |
| Wydane: |
American Chemical Society
2013
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| Dostęp online: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3665241/ https://ncbi.nlm.nih.gov/pubmed/23672464 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ci400100c |
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