diff --git a/propka/molecular_container.py b/propka/molecular_container.py index c6039c9..d1492ae 100644 --- a/propka/molecular_container.py +++ b/propka/molecular_container.py @@ -125,7 +125,7 @@ class MolecularContainer: filename: file to write to """ if filename is None: - filename = os.path.join('{0:s}.propka'.format(self.name)) + filename = os.path.join('{0:s}.propka_input'.format(self.name)) write_propka(self, filename) def write_pka(self, filename=None, reference="neutral",