Train/validation data availability? #2
Description
Hello, thank you so much for your work! Is the additional DFT data from NCIAtlas used for training publicly available?
I see PM6 and wb97M-D3BJ/def2-TZVPPD values for the validation sets are given in the SI.
I also see that the NCIAtlas repo has wb97M-D3BJ results, but at a different basis set than SPICE. Any help would be greatly appreciated!