Line Commands Testing


Testing structure correction recognition. A species can be tested against the entire set of elements or a single element:

  • OpticalSymmetryTest: Recognize optical symmetry in the species.

  • BensonAtomTest: Tests the substition of benson meta atoms (for use in Benson atom rule definition)

  • LinearAtomTest: Tests the substitution of linear structures (for use with symmetry recognition)

  • BensonRuleTest: Tests the recognition of benson rules

Examine the database elements:

  • OpticalSymmetry: Examine the optical symmetry elements.

  • BensonAtom: Examine the benson atoms that are substituted in a species, for example c/d , c/t, c/a for double, triple and aromatic carbons.

  • BensonRule: Examine the benson rules.

  • LinearAtom: Examine the linear atom definitions