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. 2018 Dec 11;23(12):3271. doi: 10.3390/molecules23123271

Table 3.

Predictive and extrapolation powers of the QSAR models derived by ANN approach.

RT2 RMSET Rv2 RMSEV
ANN 3-layers 0.75 0.54 0.48 0.68
ANN 4-layers 0.81 0.47 0.71 0.51
ANN 5-layers 0.76 0.53 0.64 0.56
ANN 6-layers 0.84 0.43 0.78 0.46
ANN 7-layers 0.90 0.34 0.85 0.39
ANN 8-layers 0.86 0.40 0.62 0.66
ANN 9-layers 0.92 0.29 0.90 0.32
ANN 10-layers 0.90 0.34 0.78 0.47
ANN 11-layers 0.91 0.32 0.72 0.62
ANN 12-layers 0.88 0.37 0.82 0.40
ANN 13-layers 0.86 0.40 0.74 0.51