diff --git a/mdpow/workflows/dihedrals.py b/mdpow/workflows/dihedrals.py index 042cd7d0..df85cdc3 100644 --- a/mdpow/workflows/dihedrals.py +++ b/mdpow/workflows/dihedrals.py @@ -259,10 +259,10 @@ def get_bond_indices(mol, atom_indices): def get_dihedral_groups(solute, atom_indices): '''Uses the 0-based `atom_indices` of the relevant dihedral atom groups - determined by :func:`~mdpow.workflows.dihedral.get_atom_indices` + determined by :func:`~mdpow.workflows.dihedrals.get_atom_indices` and returns the 1-based index names for each atom in each group. - Requires the `atom_indices` from :func:`~mdpow.workflows.dihedral.get_atom_indices` + Requires the `atom_indices` from :func:`~mdpow.workflows.dihedrals.get_atom_indices` to index the `solute` specified by :func:`~MDAnalysis.core.groups.select_atoms` and return an array of the names of each atom within its respective dihedral atom group as identified by the SMARTS selection string.