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--postdoc selections. #40

@diegoenry

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@diegoenry

Implement selections for DockFlow output using --postdock.

The actions currently in "ChemFlow_tools.bash" and allow the user to select and output:

  • ALL compounds, ranked by energy + ALL docking poses ( --postdock default )
  • SOME compounds, ranked by energy + SOME docking poses

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