Fig. 4
From: TB-IECS: an accurate machine learning-based scoring function for virtual screening
The impact of interaction energy terms on model performance: the performance of models trained on features lack of specific interactions. For example, the column ‘Vdw’ represents the performance of the model trained on the features without a description of Van der Waals’s interaction. A: heatmap of the performance of models with different features. B: the distribution of the performance of models with different features