Fig. 10

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