Geometry

The Geometry plugin provides characteristic values related to the geometrical structure of a molecule. As input molecule it can use the user input or take the lowest energy conformer of the input molecule. Calculations available:

• Dreiding energy: energy related to the stability of the actual 3D structure (conformation) of the molecule.
• Hindrance: steric hindrance of an atom calculated from the covalent radii values and geometrical distances.