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. 2020 Apr 22;12:27. doi: 10.1186/s13321-020-00430-x

Table 2.

Hyperparameters for QSPR/QSAR Model Fine-tuning

Layer groups Base Learning Rate Epochs
Linear head only 3e−2 4
Linear head + final LSTM layer 5e−3 4
Linear head + final two LSTM layers 5e−4 4
Full model 5e−5 6