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plm_slurm_args = --cpu_bind=boards |
Command to call a Schrodinger utility
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"${SCHRODINGER}/utilities/multisim" -JOBNAME desmond_md_job_TREK1model_1ms < restOfCommandOptions > |
Example Submission Script CPU
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plm_slurm_args = --cpu_bind=boards |
Code Block |
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"${SCHRODINGER}/utilities/multisim" -JOBNAME desmond_md_job_TREK1model_1ms < restOfCommandOptions > |
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