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docking-org / pydock3

Python package wrapping the DOCK Fortran program and providing several tools built on top of it.
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Add ability to run DockOpt without a job scheduler #13

Open ianscottknight opened 1 year ago

ianscottknight commented 1 year ago

Add ability to run DockOpt without specifying a job scheduler.

Aside from making DockOpt work on systems without a job scheduler, this will also make automated testing of DockOpt far easier.