change_numbering¶
-
Zmat.change_numbering(new_index=None, inplace=False)[source]¶ Change numbering to a new index.
- Changes the numbering of index and all dependent numbering
- (bond_with...) to a new_index.
- The user has to make sure that the new_index consists of distinct
- elements.
Parameters: - new_index (list) – If None the new_index is taken from 1 to the
- of atoms. (number) –
Returns: Reindexed version of the zmatrix.
Return type: