Scale many datasets: Difference between revisions

Scale many datasets (view source)

7 bytes added , 30 October

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 mkdir xscale
 cd xscale
-# create XSCALE.INP. The unit cell parameters were obtained using cellparm (XDS package) from the 36 XDS_ASCII.HKL files
+# create XSCALE.INP. Precise average cell parameters were obtained using cellparm (XDS package) from the 36 XDS_ASCII.HKL files
 echo UNIT_CELL_CONSTANTS=77.864    77.864    77.864 90 90 90 >XSCALE.INP
 echo SPACE_GROUP_NUMBER=199 >>XSCALE.INP