The total symmetry of the molecule represented by directional WHIM symmetry unweighted descriptors
The shape of the molecule represented by directional WHIM shape unweighted descriptors
The inverse of the kurtosis calculated by the fourth order moment of 1st principal component using the covariance matrix of the molecule atomic coordinates
The total dimension of a molecule represented by directional WHIM size unweighted descriptors
The total dimension of a molecule represented by directional WHIM size unweighted descriptors
the inverse of the kurtosis calculated by the fourth order moment of 3rd principal component using the covariance matrix of the molecule atomic coordinates
Variance of positive electrostatic potential at the VDW surface
Variance of all electrostatic potential at the VDW surface
Average value of negative electrostatic potential at the VDW surface
Average value of positive electrostatic potential at the VDW surface