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Discovery of novel triple helical DNA intercalators by an integrated virtual and actual screening platform

Virtual Screening is an increasingly attractive way to discover new small molecules with potential medicinal value. We introduce a novel strategy that integrates use of the molecular docking software Surflex with experimental validation by the method of competition dialysis. This integrated approach...

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Main Authors: Holt, Patrick A., Ragazzon, Patricia, Strekowski, Lucjan, Chaires, Jonathan B., Trent, John O.
Format: Artigo
Jezik:Inglês
Izdano: Oxford University Press 2009
Teme:
Online dostop:https://ncbi.nlm.nih.gov/pmc/articles/PMC2651796/
https://ncbi.nlm.nih.gov/pubmed/19136469
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1093/nar/gkn1043
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