Dipole_dz_cm_MPEOE
The dipole moment z component about center of mass (MPEOE charge)
3D_VDW_surface
The surface area of a molecular calculated by van der Waals surface area
Quadrupole_MPEOE
Total quadrupole moment (MPEOE charge)
3D_VDW_volume
The volume of a molecular calculated by van der Waals radius
Quadrupole_Qxx_cm_MPEOE
The quadrupole moment xx component about center of mass (MPEOE charge)
3D_SA_surface
The surface area of a molecule calculated as the trace of the center of the probe sphere
Quadrupole_Qyy_cm_MPEOE
The quadrupole moment yy component about center of mass (MPEOE charge)
3D_SA_volume
The volume of a molecule calculated as the trace of the center of the probe sphere
Ovality_VDW
A measure of the departure of a molecule from the spherical shape corresponding to VDW surface
Ovality_SA
A measure of the departure of a molecule from the spherical shape corresponding to solvent accessible surface