Fig. 5. MAE for predicted points (inside cutoff, green squares) and those not predicted (outside cutoff, orange squares) compared to the training data MAE (blue horizontal dashed line) along with data fraction in each set for the inorganic CSD test set (left) and organic QM9 set (right). The most distant point in the test set is scaled to have a latent distance of 1.0 for comparison across data sets but the x-axis range is then truncated to focus on the range of latent distance cutoffs that affect most of the data.