#!/bin/sh source /gpfs/cfel/cxi/common/public/cfelsoft-rh7-public/conda-setup.sh conda activate cfel_crystallography set -x check_hkl merged.hkl --highres=3 -p 5HT2B.cell cat shells.dat compare_hkl merged.hkl1 merged.hkl2 --highres=3 -p 5HT2B.cell --fom=cc cat shells.dat compare_hkl merged.hkl1 merged.hkl2 --highres=3 -p 5HT2B.cell --fom=Rsplit cat shells.dat