Table 7 kNN and GP models performance retrieved from Yosipof et al. [41]
Library | Activity | \(Q_{train}^{2}\) | \(Q_{ext}^{2} (R^{2} )\) | \(Q_{ext}^{2}\) \((R^{2} )\) (AD) | \(Q_{ext}^{2} (R^{2} )\) | |
|---|---|---|---|---|---|---|
kNN | GP | kNN | kNN | GP | ||
\(TiO_{2} |Cu_{2} O\) (Ag) | J SC | 0.92 | 0.74 | 0.92 (0.92) | 0.92 (0.92) | 0.76 (0.76) |
V OC | 0.78 | 0.65 | 0.89 (0.89) | 0.89 (0.89) | 0.78 (0.77) | |
IQE | 0.91 | 0.70 | 0.87 (0.87) | 0.87 (0.87) | 0.72 (0.73) | |
\(TiO_{2} |Cu_{2} O\) (Ag|Cu) | J SC | 0.92 | 0.76 | 0.89 (0.89) | 0.88 (0.89) | 0.74 (0.76) |
V OC | 0.74 | 0.61 | 0.56 (0.55) | 0.55 (0.54) | 0.50 (0.50) | |
IQE | 0.9 | 0.72 | 0.91 (0.91) | 0.89 (0.89) | 0.72 (0.73) | |