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1 parent 5de1a87 commit b9291d3Copy full SHA for b9291d3
config/config.yaml
@@ -96,25 +96,3 @@ PYPLOT: "vis/matplotlib/3.4.2-foss-2021b"
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PYTHON: "lang/Python/3.7.4-GCCcore-8.3.0"
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VENN: "vis/matplotlib-venn/0.11.6-foss-2020b-Python-3.8.6"
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-
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-#Cluster configuration
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-DOCKING:
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- mem_mb_per_cpu: 3000
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- jobname: docking
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- partition: covid19,parallel
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- ntasks: 384
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- constraint: caskadelake,skylake
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-ENERGY_MIN:
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- jobname: energyMin
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- mem_mb: 350
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- partition: smp,covid19
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- threads: 1
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- walltime_minutes: 90
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-DOCKING_RESULTS:
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- jobname: results
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- mem_mb: 65000
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- partition: smp
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- threads: 2
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- walltime_minutes: 300
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