Generate XDS.INP: Difference between revisions

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→‎The script: add REFINE(IDXREF)
(→‎The script: add REFINE(IDXREF))
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# fix 2010-04-26 - tell user about possible ORGX, ORGY alternatives -   
# fix 2010-04-26 - tell user about possible ORGX, ORGY alternatives -   
# at ESRF and ... (pls fill in!) the following should be used:         
# at ESRF and ... (pls fill in!) the following should be used:         
       ORGX=`echo "scale=1; $BEAM_CENTER_Y/$QX" | bc -l `               
       ORGX=`echo "scale=1; $BEAM_CENTER_Y/$QX" | bc -l`               
       ORGY=`echo "scale=1; $BEAM_CENTER_X/$QX" | bc -l `               
       ORGY=`echo "scale=1; $BEAM_CENTER_X/$QX" | bc -l`               
       echo - at ESRF BLs use: ORGX=$ORGX ORGY=$ORGY                     
       echo - at ESRF BLs use: ORGX=$ORGX ORGY=$ORGY                     
# this 2nd alternative convention should be used at the following beamlines (pls complete the list): ALS 5.0.3, ...
# this 2nd alternative convention should be used at the following beamlines (pls complete the list): ALS 5.0.3, ...
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MINIMUM_NUMBER_OF_PIXELS_IN_A_SPOT=3 ! default of 6 is sometimes too high
MINIMUM_NUMBER_OF_PIXELS_IN_A_SPOT=3 ! default of 6 is sometimes too high
! close spots: reduce SEPMIN and CLUSTER_RADIUS from their defaults of 6 and 3, e.g. to 4 and 2
! close spots: reduce SEPMIN and CLUSTER_RADIUS from their defaults of 6 and 3, e.g. to 4 and 2
! for bad or low resolution data remove the "!" in the following line:
! REFINE(IDXREF)=CELL BEAM ORIENTATION AXIS ! DISTANCE
REFINE(INTEGRATE)=CELL BEAM ORIENTATION ! AXIS DISTANCE
REFINE(INTEGRATE)=CELL BEAM ORIENTATION ! AXIS DISTANCE


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