Property Optimization on PMV21 JNK3 (test)
0.4047AUC@1Aug-Mem
Evaluation results
| Method | Links | |||||
|---|---|---|---|---|---|---|
| Aug-MemOracle calls=1,0002026.05 | 0.4047 | 0.261 | 0.1286 | 98.07 | 0.0233 | |
| GP-BOOracle calls=1,0002026.05 | 0.308 | 0.257 | 0.1633 | 26.03 | 10.7317 | |
| MolWorldOracle calls=1000, Number of runs=32026.05 | 0.2991 | 0.2543 | 0.1918 | 0.24 | 58.4911 | |
| MolWorld2026.05 | 0.2991 | 0.2543 | 0.1918 | 0.24 | 58.4911 | |
| GP-BOOracle calls=1000, Number of runs=32026.05 | 0.2941 | 0.2397 | 0.1405 | 26.03 | 10.7317 | |
| GP-BO2026.05 | 0.2941 | 0.2397 | 0.1405 | 26.03 | 10.7317 | |
| MOLWORLDOracle calls=1,0002026.05 | 0.2893 | 0.2744 | 0.2322 | 0.24 | 58.4911 | |
| MOLLEOOracle calls=1,0002026.05 | 0.2424 | 0.1944 | 0.1271 | 27.37 | 7.1437 | |
| MOLLEOOracle calls=1000, Number of runs=32026.05 | 0.2381 | 0.1923 | 0.1249 | 27.37 | 7.1437 | |
| MOLLEO2026.05 | 0.2381 | 0.1923 | 0.1249 | 27.37 | 7.1437 | |
| NFBOOracle calls=1,0002026.05 | 0.2252 | 0.1925 | 0.1341 | 31.91 | 6.3131 | |
| REINVENTOracle calls=1,0002026.05 | 0.224 | 0.1553 | 0.0942 | 90.73 | 0.232 | |
| Aug-MemOracle calls=1000, Number of runs=32026.05 | 0.1991 | 0.0745 | 0.0087 | 98.07 | 0.0233 | |
| Aug-Mem2026.05 | 0.1991 | 0.0745 | 0.0087 | 98.07 | 0.0233 | |
| GraphGAOracle calls=1,0002026.05 | 0.1977 | 0.1546 | 0.104 | 32.37 | 6.6723 | |
| GraphGAOracle calls=1000, Number of runs=32026.05 | 0.1977 | 0.1541 | 0.1026 | 32.37 | 6.6723 | |
| GraphGA2026.05 | 0.1977 | 0.1541 | 0.1026 | 32.37 | 6.6723 | |
| REINVENTOracle calls=1000, Number of runs=32026.05 | 0.1498 | 0.0908 | 0.0264 | 90.73 | 0.232 | |
| REINVENT2026.05 | 0.1498 | 0.0908 | 0.0264 | 90.73 | 0.232 |