1st eigenvalue of the covariance matrix weighted by SMR of the molecule atomic coordinates, which account for the molecular size
The total dimension of a molecule represented by directional WHIM size SMR descriptors
2nd eigenvalue of the covariance matrix weighted by SMR of the molecule atomic coordinates, which account for the molecular size
The total dimension of a molecule represented by directional WHIM size SMR descriptors
3rd eigenvalue of the covariance matrix weighted by SMR of the molecule atomic coordinates, which account for the molecular size
eigenvalue ratio of 1st direction WHIM size descriptor and sum of directional WHIM size descriptors weighted by SMR
The inverse of the kurtosis calculated by the fourth order moment of 1st principal component described by SlogP
The shape of the molecule represented by directional WHIM shape E-state descriptors
the inverse of the kurtosis calculated by the fourth order moment of 2nd principal component described by SlogP
The total symmetry of the molecule represented by directional WHIM symmetry E-state descriptors