diff --git a/MANIFEST.in b/MANIFEST.in new file mode 100644 index 00000000..cf8dae6c --- /dev/null +++ b/MANIFEST.in @@ -0,0 +1 @@ +include mace/py.typed diff --git a/mace/py.typed b/mace/py.typed new file mode 100644 index 00000000..8b137891 --- /dev/null +++ b/mace/py.typed @@ -0,0 +1 @@ + diff --git a/mace/tools/arg_parser.py b/mace/tools/arg_parser.py index 1eb033be..2b0e2b56 100644 --- a/mace/tools/arg_parser.py +++ b/mace/tools/arg_parser.py @@ -134,7 +134,7 @@ def build_default_arg_parser() -> argparse.ArgumentParser: ) parser.add_argument( "--pair_repulsion", - help="use amsgrad variant of optimizer", + help="use pair repulsion term with ZBL potential", action="store_true", default=False, )