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Incorporating Target Protein Structure Flexibility and Dynamics in Computational Drug Discovery Using Ensemble-Based Docking Analysis
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Tautomer preference in PDB complexes and its impact on structure-based drug discovery

Francesca Milletti1, Anna Vulpetti

  • 1CADD, Global Discovery Chemistry, Novartis Institutes for Biomedical Research, CH4002 Basel, Switzerland.

Journal of Chemical Information and Modeling
|June 3, 2010
PubMed

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