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Article ID: 978 - Last Modified:

How can I restart a VSW job?

To restart a VSW job, just run it from the command line with the command

$SCHRODINGER/vsw jobname.inp

You will be prompted to indicate whether to resume the job where it left off, restart from the beginning, or abort. You can also use the -RESTART and -OVERWRITE options to indicate what to do, and avoid the interactive prompt. On Windows you should open a Schrodinger Command Prompt window (Start → All Programs → Schrodinger-2011) to run this command (or a SchrodingerShell prior to 2011).

Keywords: Virtual Screening Workflow

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