Comparing these different methods, we identify certain advantages and disadvantages. SHAP values are fast to calculate and have great and relatively intuitive visualizations for tabular data. However, their use is limited for molecules, where highlighting individual fingerprint bits only works for bits actually present for the molecule and limited to a small number of bits for clarity. In contrast with the Myerson values, it is not possible to assign an intuitive atomwise importance. In addition, SHAP values do not work with GNNs and the representation of the molecule using a