mbuild_polybuild.aa_fragments.c_quaternary.C.to_smiles

C.to_smiles(backend='pybel')

Create a SMILES string from an mbuild compound.

Parameters:
  • compound (mb.Compound.) – The mbuild compound to be converted.

  • backend (str, optional, default=”pybel”) – Backend used to do the conversion.

Returns:

smiles_string

Return type:

str