Lin, Yen-Lin

Computational study of Gleevec and G6G reveals molecular determinants of kinase inhibitor selectivity. [electronic resource] - Journal of the American Chemical Society Oct 2014 - 14753-62 p. digital

Publication Type: Journal Article; Research Support, N.I.H., Extramural; Research Support, U.S. Gov't, Non-P.H.S.

1520-5126

10.1021/ja504146x doi


Amino Acid Sequence
CSK Tyrosine-Protein Kinase
Imatinib Mesylate--metabolism
Molecular Dynamics Simulation
Protein Conformation
Protein Kinase Inhibitors--metabolism
Proto-Oncogene Proteins c-abl--antagonists & inhibitors
Solvents--chemistry
Substrate Specificity
Thermodynamics
src-Family Kinases--antagonists & inhibitors