This page shows the publications Onur Dagliyan has written about Molecular Dynamics Simulation.
Structure based discovery of small molecules to regulate the activity of human insulin degrading enzyme. PLoS One. 2012; 7(2):e31787.
Structural and dynamic determinants of protein-peptide recognition. Structure. 2011 Dec 07; 19(12):1837-45.
Classification of cytochrome P450 inhibitors with respect to binding free energy and pIC50 using common molecular descriptors. J Chem Inf Model. 2009 Oct; 49(10):2403-11.
Intrinsic disorder mediates cooperative signal transduction in STIM1. J Mol Biol. 2014 May 15; 426(10):2082-97.
Identification of novel integrin binding partners for calcium and integrin binding protein 1 (CIB1): structural and thermodynamic basis of CIB1 promiscuity. Biochemistry. 2013 Oct 08; 52(40):7082-90.
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