Table 6 Running time of serial and GPU versions of random forest virtual screening for training
From: GPURFSCREEN: a GPU based virtual screening tool using random forest classifier
Dataset | No of molecules | Time for (s) serial | Time for (s) for GPU |
|---|---|---|---|
AID 1332 | 1193 | 0.0689 | 1.114 |
AID 492952 | 2294 | 0.2095 | 1.2054 |
AID 651616 | 5569 | 0.6641 | 1.7984 |
AID 2330 | 36,869 | 4.2428 | 2.5487 |
AID 893 | 68,532 | 11.5306 | 3.2746 |
AID 778 | 95,859 | 35.8603 | 9.9027 |
AID 434955 | 323,578 | 81.323 | 10.44 |
AID 2314 | 330,664 | 100.57 | 10.77 |