Mass quadrupole moment Q3 about molecular centroid
Mass quadrupole moment Qxx about center of polarizability(cp)
Mass quadrupole moment Qxx about molecular centroid
Mass quadrupole moment Qyy about center of polarizability(cp)
Mass quadrupole moment Qyy about molecular centroid
Mass quadrupole moment Qzz about molecular centroid
the inverse of the kurtosis calculated by the fourth order moment of 3rd principal component described by SMR
The total density of the atoms accounted for by directional WHIM density SlogP descriptors within a molecule
The total dimension of a molecule represented by directional WHIM size SMR descriptors
1st eigenvalue of the covariance matrix weighted by SMR of the molecule atomic coordinates, which account for the molecular size