Xscale

XSCALE ist the scaling program of the XDS suite.

The latest versions do not require

SPACE_GROUP_NUMBER=
UNIT_CELL_PARAMETERS=

in XSCALE.INP because they pick these parameters up from the header of the first input reflection file.

A minimal input file to combine two datasets into one file is:

OUTPUT_FILE=fae-merge.ahkl 
INPUT_FILE= ../fae-ip/xds_1/XDS_ASCII.HKL
INPUT_FILE= ../fae-ip/xds_2/XDS_ASCII.HKL

Much more to come