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Mark unused configuration parameter
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tests/test_moldrug.py

Lines changed: 2 additions & 1 deletion
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@@ -58,7 +58,7 @@
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# That being said, an example cluster configuration can be adopted to your needs.
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#
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# Note on Elwe: Worker nodes of Elwe are unable to reach the controller when MolDrug is running directly on the frontend.
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# One way to circumvent it is to run tests from an interactive node, eg. by calling `elwe slot`, `pytest tests -k test_multi_receptor`.
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# One way to circumvent it is to run tests from an interactive job, eg. by calling `elwe slot`, `pytest tests -k test_multi_receptor`.
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# Sending the main job to the queue works as well
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# sbatch --partition uds-hub --nodes 1 --mem-per-cpu 1GB --time 00:15:00 --ntasks-per-node 10 --gres gpu:1 --constraint 'XEON_E5_2630v4' \
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# --wrap 'bash -c "source .venv/bin/activate ; pytest tests -k test_multi_receptor"'
@@ -118,6 +118,7 @@ def test_single_receptor_command_line():
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elif execution_mode in ["smaug", "elwe"]:
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assert dask_available
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# This is currently unused
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if execution_mode == "smaug":
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Config['01_grow']['cluster'] = {
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"SLURMCluster_kwargs": {

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