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. 2023 Oct 10;15(10):608. doi: 10.3390/toxins15100608

Table 1.

Search range of hyperparameters for developed machine learning models.

Hyperparameters XGBoost LightGBM CatBoost
reg_alpha 1 × 10−5, 1 × 10−4, 1 × 10−3, 1 × 10−2, 0.1, 1, 5, 10, 100 -
reg_lambda -
colsample_bytree 0.5~1.0 (0.1) -
min_child_weight 250~350 (10) -
eta 0.1~0.3 (0.1) -
l2_leaf_reg - 3~8 (1)
border_count - 32~255 (10)
colsample_bylevel - 0.3~0.8 (0.1)
bagging_temperature - 0~10
min_data_in_leaf - 1, 5, 10, 20, 30
max_depth 10~25 (1) 3~9 (1)
subsample 0.7~0.9 (0.1) 0.5~1.0
learning_rate 0.01~0.05 (0.005)
n_estimators 1000~10,000 (10)
eval_metric Root Mean Square Error