Fig. 6

Cross-validated performance (RMSE) of the top performing models (excluding models incorporating the melting point or crystal structure based 3D descriptors) where the lattice energy (LE) descriptor was incorporated (LHS), compared to the corresponding model which didn’t include the lattice energy descriptor (RHS): a dataset = Avdeef_ExDPs_CS_True; b dataset = Klimenko_CS_True, CV = rt. All results are presented as per Fig. 5