# Copyright 2022-2026 The Ramble Authors
#
# Licensed under the Apache License, Version 2.0 <LICENSE-APACHE or
# https://www.apache.org/licenses/LICENSE-2.0> or the MIT license
# <LICENSE-MIT or https://opensource.org/licenses/MIT>, at your
# option. This file may not be copied, modified, or distributed
# except according to those terms.
import os
import pytest
import ramble.workspace
from ramble.error import DirectiveError, InvalidModeError
from ramble.main import RambleCommand
from ramble.test.dry_run_helpers import SCOPES, dry_run_config
from ramble.test.modifier_functionality import modifier_helpers
workspace = RambleCommand("workspace")
[docs]
@pytest.mark.long
@pytest.mark.parametrize(
"scope",
[
SCOPES.workspace,
SCOPES.application,
SCOPES.workload,
SCOPES.experiment,
],
)
@pytest.mark.parametrize("modifier_mode", [None, "disabled"]) # Default mode
def test_gromacs_dry_run_mock_mods(
mutable_mock_workspace_path,
mutable_applications,
mock_modifier,
mock_modifiers,
scope,
modifier_mode,
workspace_name,
):
test_modifiers = [
(scope, modifier_helpers.named_modifier(mock_modifier, modifier_mode)),
]
expected_failures = {
"multiple-modes-no-default": {"error": InvalidModeError, "msg": "Cannot auto determine"},
"invalid-builtin-injection": {
"error": DirectiveError,
"msg": "has an invalid injection method of",
},
}
with ramble.workspace.create(workspace_name) as ws1:
ws1.write()
config_path = os.path.join(ws1.config_dir, ramble.workspace.CONFIG_FILE_NAME)
dry_run_config("modifiers", test_modifiers, config_path, "gromacs", "water_bare")
ws1._re_read()
if modifier_mode != "disabled" and mock_modifier in expected_failures:
with pytest.raises(
expected_failures[mock_modifier]["error"],
match=expected_failures[mock_modifier]["msg"],
):
workspace("concretize", global_args=["-D", ws1.root])
else:
workspace("concretize", global_args=["-D", ws1.root])
workspace("setup", "--dry-run", global_args=["-D", ws1.root])
exp_script = os.path.join(
ws1.experiment_dir, "gromacs", "water_bare", "test_exp", "execute_experiment"
)
assert os.path.isfile(exp_script)