Scoring function | Success rates (%) | ||
---|---|---|---|
The top pose | Top two poses | Top three poses | |
ChemPLP@GOLD | 81 | 86.7 | 89.7 |
ChemScore@GOLD | 77.9 | 83.1 | 88.2 |
GlideScore-SP | 78.5 | 85.6 | 87.7 |
ASP@GOLD | 71.8 | 81.5 | 87.2 |
LigScore2@DS | 76.9 | 84.1 | 86.7 |
PLP1@DS | 77.4 | 84.1 | 86.2 |
PLP2@DS | 74.4 | 81.5 | 86.2 |
Alpha-HB@MOE | 75.4 | 82.6 | 86.2 |
GoldScore@GOLD | 71.3 | 81 | 85.6 |
GlideScore-XP | 74.4 | 82.6 | 85.6 |
LUDI1@DS | 59 | 75.4 | 83.1 |
LUDI2@DS | 65.6 | 75.4 | 81.5 |
LigScore1@DS | 65.1 | 74.9 | 81 |
Affinity-dG@MOE | 63.1 | 74.9 | 81 |
London-dG@MOE | 59.5 | 73.8 | 78.5 |
X-ScoreHM | 61 | 73.3 | 77.9 |
ChemScore@SYBYL | 59.5 | 69.2 | 75.4 |
X-Score | 59.5 | 69.2 | 75.4 |
DLIGAND2 | 45.1 | 61 | 75.4 |
X-ScoreHP | 54.4 | 67.7 | 73.8 |
LUDI3@DS | 48.7 | 65.1 | 72.8 |
GScore@SYBYL | 45.1 | 61.5 | 72.3 |
X-ScoreHS | 54.4 | 66.7 | 72.3 |
Jain@DS | 48.2 | 62.1 | 70.8 |
PMF@SYBYL | 51.8 | 60 | 66.7 |
PMF04@DS | 51.8 | 62.6 | 66.2 |
ASE@MOE | 51.3 | 60 | 63.6 |
PMF@DS | 44.1 | 52.3 | 60 |
DLIGAND | 31.3 | 50.3 | 60.5 |
dSAS | 21.5 | 33.3 | 45.1 |
DScore@SYBYL | 18.5 | 29.7 | 42.6 |