Differential Water Thermodynamics Determine PI3K-Beta/Delta Selectivity for Solvent-Exposed Ligand Modifications.

Robinson, Daniel

Differential Water Thermodynamics Determine PI3K-Beta/Delta Selectivity for Solvent-Exposed Ligand Modifications. [electronic resource] - Journal of chemical information and modeling 05 2016 - 886-94 p. digital

Publication Type: Journal Article

1549-960X

10.1021/acs.jcim.5b00641 doi


Ligands
Molecular Dynamics Simulation
Phosphatidylinositol 3-Kinases--chemistry
Protein Conformation
Protein Subunits--chemistry
Solvents--chemistry
Substrate Specificity
Thermodynamics
Water--chemistry