schrodinger.job.jobwriter module¶

Functions for writing job command lists into shell scripts.

schrodinger.job.jobwriter.write_job_cmd(cmdlist, sh_filename, job_dir, append=False)¶

Write a shell script that can be used to run the given cmdlist.

Parameters

cmdlist (list[str]) – The command the script should run.
sh_filename (sh) – The name of the file the script should be written to
job_dir (str) – The desired job directory to be used for the command
append (bool) – Whether to append to the given file or overwrite it. This is useful for writing a single shell script that launches multiple jobs.

schrodinger.job.jobwriter.cmdlist_to_cmd(cmdlist)¶

Converts a command list to a command string. Don’t do this if you can possibly avoid it.