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 total dimension of a molecule represented by directional WHIM size unweighted descriptors
The shape of the molecule represented by directional WHIM shape unweighted descriptors
The total symmetry of the molecule represented by directional WHIM symmetry unweighted descriptors
The total density of the atoms accounted for by directional WHIM density unweighted descriptors within a molecule
1st eigenvalue of the covariance matrix weighted by mass of the molecule atomic coordinates, which account for the molecular size
The quadrupole moment zz component about center of mass (MPEOE charge)
Maximum electrostatic potential at the VDW surface
Minimum electrostatic potential at the VDW surface