WHIM_gWDEN_D_Un
The total density of the atoms accounted for by directional WHIM density unweighted descriptors within a molecule
WHIM_3dWSHA_Un
eigenvalue ratio of 3rd direction WHIM size descriptor and sum of directional WHIM size descriptors using eigenvalue of the covariance matrix of the molecule atomic coordinates
WHIM_1dWSIZ_Mass
1st eigenvalue of the covariance matrix weighted by mass of the molecule atomic coordinates, which account for the molecular size
WHIM_1dWSYM_Un
mean information content on the symmetry along 1st principal component using the covariance matrix of the molecule atomic coordinates
WHIM_2dWSYM_Un
mean information content on the symmetry along 2nd principal component using the covariance matrix of the molecule atomic coordinates
WHIM_3dWSYM_Un
mean information content on the symmetry along 3rd principal component using the covariance matrix of the molecule atomic coordinates
Vs_pos_ave_VDW_surface
Average value of positive electrostatic potential at the VDW surface
Variance_pos_Vs_SA_surface
Variance of positive electrostatic potential on the solvent accessible surface
Vs_neg_ave_VDW_surface
Average value of negative electrostatic potential at the VDW surface
Variance_neg_Vs_SA_surface
Variance of negative electrostatic potential on the solvent accessible surface