%0 Journal Article %K Computer Simulation %K Thermodynamics %K Drug Design %K Humans %K Receptor, EphB4 %K Structure-Activity Relationship %K Binding Sites %K Protein Kinase Inhibitors %K Quantum Theory %K Small Molecule Libraries %K High-Throughput Screening Assays %B ChemMedChem %D 2010 %G eng %N 7 %P 1007-1014 %R 10.1002/cmdc.201000085 %T High-throughput virtual screening using quantum mechanical probes: Discovery of selective kinase inhibitors %V 5 %1 0133 %8 2010 Jul 5 %9 Research Article