What it does
This tool determines the shape and feature overlap of docked ligand poses compared to a reference molecule, usually a known ligand. The RDKit FeatureMap functionality is used to do the scoring.
Molecules such as an SD file dataset from the history.
The same SD file with a "SuCOS_Score" property added. A score of 1.0 infers a perfect overlap, a score of 0.0 no overlap. A rule of thumb is that poses with a score greater than 0.5 can be be considered "useful".