diff --git a/docs/workflow/input.rst b/docs/workflow/input.rst index 56d5f22..74b7dbc 100644 --- a/docs/workflow/input.rst +++ b/docs/workflow/input.rst @@ -92,3 +92,6 @@ except for :code:`.sdf` files, which can contain multiple molecules. The molecul :code:`_Name` or their filename if the property is not set. In case of :code:`.sdf` files and molecules without :code:`_Name` property, the index at which they are stored in the file is used as suffix to distinguish between molecules in the same file. + +Example files for :code:`.mol`, :code:`.mrv`, :code:`.pdb`, and :code:`.tpl` are given in +:code:`tests/data/pipeline/mol_formats//`.