3D_SA_volume
The volume of a molecule calculated as the trace of [...]
Ovality_VDW
A measure of the departure of a molecule from the [...]
Ovality_SA
A measure of the departure of a molecule from the [...]
LB_ratio
The ratio of the longest to the shortest side of [...]
Mol_thickness
Molecular thickness
Mass_density
Mass density
Dipole_MPEOE
A vector quantity which encodes displacement with respect to the [...]
Dipole_dx_cm_MPEOE
The dipole moment x component about center of mass (MPEOE [...]
Dipole_dy_cm_MPEOE
The dipole moment y component about center of mass (MPEOE [...]
Dipole_dz_cm_MPEOE
The dipole moment z component about center of mass (MPEOE [...]