COMMA2_Qxx_mass_cm
Mass quadrupole moment Qxx about center of mass(cm)
COMMA2_Qyy_mass_cm
Mass quadrupole moment Qyy about center of mass(cm)
COMMA2_Qzz_mass_cm
Mass quadrupole moment Qzz about center of mass(cm)
COMMA2_Qxx_mass_cc
Mass quadrupole moment Qxx about center of charge(cc)
WHIM_gWSHA_K_SMR
The shape of the molecule represented by directional WHIM shape SMR descriptors
COMMA2_Qyy_mass_cc
Mass quadrupole moment Qyy about center of charge(cc)
WHIM_gWSYM_G_SMR
The total symmetry of the molecule represented by directional WHIM symmetry SMR descriptors
COMMA2_Qzz_mass_cc
Mass quadrupole moment Qzz about center of charge(cc)
WHIM_gWDEN_D_SMR
The total density of the atoms accounted for by directional WHIM density SMR descriptors within a molecule
COMMA2_Qxx_mass_cv
Mass quadrupole moment Qxx about center of VDW radius value(cv)