comparison tools/rdock/bin/make_grid.csh @ 0:bc03dbb6eb37 draft

planemo upload commit 781926e52355f7805db8d9a4ccafeff397b19aa4-dirty

0:bc03dbb6eb37

#!/bin/csh -f
# Creates vdW grids for all receptor prm files listed on command line
#
set gridstep = 0.3
set border = 1.0

foreach grid ('vdw1' 'vdw5') 
  foreach file ($argv)
      $RBT_ROOT/bin/rbcalcgrid -r${file} -pcalcgrid_${grid}.prm -o_${grid}.grd -g${gridstep} -b${border}
  end
end