Sentence examples for measure of docking from inspiring English sources
Besides accurate binding energy estimation, a measure of docking accuracy is a good geometry, i.e. low RMSD value of the docked ligand as compared to the crystal structure.
The use of decoy sets provides a useful measure of the discriminatory power of a docking process, measuring the ability of the docking procedure to identify active compounds early from an unbiased series.
However, our findings do suggest that frequency of docking had a significant relationship with the measures examined.
They also added the log P value to the docking score, as a measure of the ability of the compounds to cross the membranes by diffusion.
The number of docking sites affects the drug docking speed.
Thus, please beware of docking!
Figure 3 Illustration of docking settings.
Curated protein structures, docking grids, complete list of Docking Scores, and docking poses for all compounds are available upon request.
The above example shows the results of docking with two drugs in Curated Kinase Docking.
Initially, the performance of docking software was tested by re-docking experiment.
This partial loss of docking is consistent with the idea of multiple docking pathways in synapses.
