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Resolution: standard / high Figure 9.
Shown is the case where USR performs better than the 3DZD and SIMCOMP and retrieves
more actives in the top 100. The query is indicated at the top of the figure. Active molecules are identified
as those with numbers (in bold) which indicate the ranks. The first three molecules
in each column are the top ranked molecules and the last two are top ranked active
molecules.
Venkatraman et al. Journal of Cheminformatics 2009 1:19 doi:10.1186/1758-2946-1-19 |