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Molecular Docking Screens Using Comparative Models of Proteins

Two orders of magnitude more protein sequences can be modeled by comparative modeling than have been determined by X-ray crystallography and NMR spectroscopy. Investigators have nevertheless been cautious about using comparative models for ligand discovery because of concerns about model errors. We...

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Bibliographic Details
Main Authors: Fan, Hao, Irwin, John J., Webb, Benjamin M., Klebe, Gerhard, Shoichet, Brian K., Sali, Andrej
Format: Artigo
Language:Inglês
Published: 2009
Subjects:
Online Access:https://ncbi.nlm.nih.gov/pmc/articles/PMC2790034/
https://ncbi.nlm.nih.gov/pubmed/19845314
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ci9003706
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