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[pre-commit.ci] auto fixes from pre-commit.com hooks
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pre-commit-ci[bot] committed Apr 1, 2024
1 parent ca0afe5 commit 12ad926
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Showing 2 changed files with 6 additions and 3 deletions.
8 changes: 5 additions & 3 deletions physical_validation/tests/test_data_gromacs_parser.py
Original file line number Diff line number Diff line change
Expand Up @@ -39,9 +39,11 @@ def get_gromacs_simulation_data(
mdp=gromacs_files["parameters"],
top=gromacs_files["topology"],
edr=gromacs_files["energy"],
gro=gromacs_files["final configuration"]
if not use_full_trajectory
else None,
gro=(
gromacs_files["final configuration"]
if not use_full_trajectory
else None
),
trr=gromacs_files["trajectory"] if use_full_trajectory else None,
)

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1 change: 1 addition & 0 deletions physical_validation/util/error.py
Original file line number Diff line number Diff line change
Expand Up @@ -18,6 +18,7 @@

class PhysicalValidationError(Exception):
r"""Base class for exceptions in the physical_validation module."""

pass


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