Table 1.
The number of correct predictions by fusion method in the external validation set.
Descriptor Sets | S4 | S3 | S2 | S1 |
---|---|---|---|---|
Combinatorial descriptor | 73 | 76 | 73 | 70 |
Mordred descriptor | 74 | 74 | 75 | 72 |
MACCS fingerprint | 70 | 74 | 74 | 71 |
Topological fingerprint | 74 | 75 | 74 | 75 |
Morgan fingerprint | 73 | 69 | 75 | 70 |