diff --git a/.pre-commit-config.yaml b/.pre-commit-config.yaml index 1bef46a..9035f09 100644 --- a/.pre-commit-config.yaml +++ b/.pre-commit-config.yaml @@ -6,7 +6,7 @@ repos: - id: end-of-file-fixer - id: trailing-whitespace - repo: https://github.com/psf/black - rev: 23.12.0 + rev: 24.1.1 hooks: - id: black args: [--line-length=80] diff --git a/grits/__init__.py b/grits/__init__.py index 64f1d42..bdcac03 100644 --- a/grits/__init__.py +++ b/grits/__init__.py @@ -1,4 +1,5 @@ """GRiTS: A coarse-grain toolkit using chemical grammars.""" + from importlib.metadata import PackageNotFoundError, version from . import utils diff --git a/grits/coarsegrain.py b/grits/coarsegrain.py index 2acc810..28e3d72 100644 --- a/grits/coarsegrain.py +++ b/grits/coarsegrain.py @@ -1,4 +1,5 @@ """GRiTS: Coarse-graining tools.""" + import json import os import tempfile diff --git a/grits/finegrain.py b/grits/finegrain.py index 7c4e3ec..62fb57a 100644 --- a/grits/finegrain.py +++ b/grits/finegrain.py @@ -1,4 +1,5 @@ """GRiTS: Fine-graining tools.""" + __all__ = ["backmap"] import itertools as it diff --git a/grits/utils.py b/grits/utils.py index 32d823f..ce3487b 100644 --- a/grits/utils.py +++ b/grits/utils.py @@ -1,4 +1,5 @@ """Utility functions for GRiTS.""" + import json import re import warnings