Running docking 3.7

Revision as of 17:56, 25 February 2014 by Frodo (talk | contribs)
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To set up directories for docking using DOCK 3.7, use:  <num_dirs>  <prefix>  /path/to/db2/files

Then to start the docking using the queuing system


If you haven't set up SGE or other queuing system, you can still run docking on your local machine.


If you have more free CPUs than jobs to run, you can use:


However, if you have more jobs to run than CPUs, you may find this overloads and crashes your computer.

When docking is complete, you can combine the results and sort them using

Return to DOCK 3.7