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Table 3 Assessment of the rescoring results

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

Sampling Rescoring
Glidescore Surflex Goldscore FlexX
A—Number of correct top-rank poses
 Glide 65 58 70 63
 Surflex 63 56 64 67
 Gold 64 63 62 62
 FlexX 51 58 56 50
 Pool 75 63 73 64
  1. Number of targets whose top-rank poses (A) or top-4 rank poses (B) are correct after rescoring. Either all poses obtained with a given program were rescored with all programs (lines 1–4) or all poses were grouped in one pool and rescored with all programs (last line). The results of USC are reported in the last column of (B)
Sampling Rescoring
Glidescore Surflex Goldscore FlexX USC
B—Number of correct top-4 rank poses
 Glide 76 74 75 71 75
 Surflex 73 72 75 75 74
 Gold 71 70 71 69 70
 FlexX 62 63 62 57 63
 Pool 82 79 86 72 85
  1. Number of targets whose top-rank poses (A) or top-4 rank poses (B) are correct after rescoring. Either all poses obtained with a given program were rescored with all programs (lines 1–4) or all poses were grouped in one pool and rescored with all programs (last line). The results of USC are reported in the last column of (B)