Fig. 4From: NEEMP: software for validation, accurate calculation and fast parameterization of EEM chargesGraph of QM and EEM charges correlation for Cheminf2015_mpa parameter set (a) and Cheminf2015_npa parameter set (b) on the dataset CCD_gen_all. The graph for Cheminf2015_mpa includes a marked correlation problem at C3 atoms (they are in green), the graph for Cheminf2015_npa shows a slight correlation issue at S2 atoms (they are in brown)Back to article page