From: Assessment and validation of the CAESAR predictive model for bioconcentration factor (BCF) in fish
Training set | Observed logBCF | Validation set | Observed logBCF | External set | Observed logBCF | |||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
450 comp. | nB | B | vB | 103 comp. | nB | B | vB | 82 comp. | nB | B | vB | |||
Predicted logBCF | nB | 77.56 (349) | 2.22 (10) | 0.44 (2) | Predicted logBCF | nB | 78.64 (81) | 1.94 (2) | 0.97 (1) | Predicted logBCF | nB | 26.83 (22) | 6.10 (5) | 1.22 (1) |
 | B | 4.44 (20) | 1.11 (5) | 1.56 (7) |  | B | 2.91 (3) | 0.097 (1) | 0.97 (1) |  | B | 12.20 (10) | 6.10 (5) | 2.44 (2) |
 | vB | 4.22 (19) | 1.56 (7) | 6.89 (31) |  | vB | 4.85 (5) | 1.94 (2) | 6.80 (7) |  | vB | 17.07 (14) | 8.54 (7) | 19.51 (16) |