MOESM2 of Efficient conformational sampling and weak scoring in docking programs? Strategy of the wisdom of crowds

Additional file 2: Table S1. Table gathering the results of docking and protein and ligand properties. The target name from DUD-E is given in column A. The difficulty of docking and ranking, column B, is colored in green for the 28 easy targets (top-ranked with all programs), in red for the 6 hard targets (with no correct best pose found with any program), in pink for the 9 best but not top-rank targets exposed in Table 5 (a correct best pose found by at least one program but not top-ranked with any scoring function when rescored in one pool). The rest is in gray. The protein properties are given in columns C to G and the ligand properties in columns H to O. Then follow the RMSDs of the top-rank and best poses obtained when docking with Glide (columns P, Q), Surflex (R, S), FlexX (T, U) and Gold (V, W).