Table 7 QSAR-RFR(SPCA) simulation results on ECFP_6 dataset
Number of features | \(R^2\) value | Running time |
|---|---|---|
60% | 0.321 | 12.87 |
70% | 0.384 | 17.02 |
80% | 0.231 | 22.87 |
90% | 0.408 | 33.1 |
100% (without feature selection) | 0.233 | 87.61 |
Number of features | \(R^2\) value | Running time |
|---|---|---|
60% | 0.321 | 12.87 |
70% | 0.384 | 17.02 |
80% | 0.231 | 22.87 |
90% | 0.408 | 33.1 |
100% (without feature selection) | 0.233 | 87.61 |