JNK3 Property Optimization on ZINC
94.73AUC@1MOLWORLD
Evaluation results
| Method | Links | |||||
|---|---|---|---|---|---|---|
| MOLWORLDOracle calls=100002026.05 | 94.73 | 92.01 | 88.95 | 1.79 | 54.261 | |
| NFBOOracle calls=100002026.05 | 89.95 | 84.93 | 75.08 | 34.79 | 359.5501 | |
| MOLLEOOracle calls=100002026.05 | 85.03 | 82.66 | 77.84 | 23.34 | 10.9031 | |
| Aug-MemOracle calls=100002026.05 | 81.58 | 78.64 | 74.24 | 53.48 | 8.2912 | |
| REINVENTOracle calls=100002026.05 | 81.22 | 78.29 | 73.97 | 26.47 | 35.4058 | |
| GraphGAOracle calls=100002026.05 | 63.95 | 60.93 | 55.37 | 38.02 | 6.191 | |
| GP-BOOracle calls=100002026.05 | 41.63 | 37.19 | 32.39 | 9.91 | 28.4886 |