From: Multi-task learning with a natural metric for quantitative structure activity relationship learning
MOL_ID | TID | SimToTID_7 | ... | SimToTID_95 | FP_1 | FP_2 | ... | Activity |
---|---|---|---|---|---|---|---|---|
ID_1 | 7 | 1 | ... | 0.584 | 1 | 0 | ... | 6.351 |
ID_2 | 7 | 1 | ... | 0.584 | 0 | 1 | ... | 7.534 |
... | ... | ... | ... | ... | ... | ... | ... | ... |
ID_111 | 95 | 0.584 | ... | 1 | 1 | 1 | ... | 8.001 |
ID_112 | 95 | 0.584 | ... | 1 | 1 | 1 | ... | 6.239 |