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Computational insights into the binding of IN17 inhibitors to MELK

Matthew Harger1, Ju-Hyeon Lee2, Brandon Walker1

  • 1Department of Biomedical Engineering, The University of Texas at Austin, Austin, TX, 78712, USA.

Journal of Molecular Modeling
|May 10, 2019
PubMed

Keywords:
Free energy calculationKinase inhibitorMELKMolecular dynamics

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