the inverse of the kurtosis calculated by the fourth order moment of 3rd principal component using the covariance matrix of the molecule atomic coordinates
Electrostatic balance parameter on the solvent accessible surface
The total dimension of a molecule represented by directional WHIM size unweighted descriptors
1st eigenvalue of the covariance matrix of the molecule atomic coordinates, which account for the molecular size
The total dimension of a molecule represented by directional WHIM size unweighted descriptors
2nd eigenvalue of the covariance matrix of the molecule atomic coordinates, which account for the molecular size
The total dimension of a molecule represented by directional WHIM size unweighted descriptors
3rd eigenvalue of the covariance matrix of the molecule atomic coordinates, which account for the molecular size
The shape of the molecule represented by directional WHIM shape unweighted descriptors
eigenvalue ratio of 1st direction WHIM size descriptor and sum of directional WHIM size descriptors using eigenvalue of the covariance matrix of the molecule atomic coordinates