Generate XDS.INP: Difference between revisions

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rev. 0.43
(ver. 0.42)
(rev. 0.43)
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# revision 0.41 . recognize header starting with R-AXIS instead of RAXIS
# revision 0.41 . recognize header starting with R-AXIS instead of RAXIS
# revision 0.42 . Keitaro 5/2014 automatically set ROTATION_AXIS=-1 0 0 for Q315 at SPring-8 BL38B1.
# revision 0.42 . Keitaro 5/2014 automatically set ROTATION_AXIS=-1 0 0 for Q315 at SPring-8 BL38B1.
REVISION="0.42 (01-May-2014)"
# revision 0.43 . Keitaro 5/2014 add experimental support of dTREK format (raxis_smv)
REVISION="0.43 (01-May-2014)"
#                                                                                                             
#                                                                                                             
# usage: e.g. generate_XDS.INP "frms/mydata_1_???.img"                                                       
# usage: e.g. generate_XDS.INP "frms/mydata_1_???.img"                                                       
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head -n1 tmp2 | grep -q "^RAXIS" && DET=raxis
head -n1 tmp2 | grep -q "^RAXIS" && DET=raxis
head -n1 tmp2 | grep -q "^R-AXIS" && DET=raxis
head -n1 tmp2 | grep -q "^R-AXIS" && DET=raxis
grep -q "^DETECTOR_TYPE=RAXIS" tmp2 && DET=raxis_smv
grep -q mar345 tmp2 && DET=MAR345                         
grep -q mar345 tmp2 && DET=MAR345                         


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   X_RAY_WAVELENGTH=$(python -c 'import struct; f=open("'$FIRSTFRAME'","rb");f.seek(292);print "%.6f"%struct.unpack(">f",f.read(4))')
   X_RAY_WAVELENGTH=$(python -c 'import struct; f=open("'$FIRSTFRAME'","rb");f.seek(292);print "%.6f"%struct.unpack(">f",f.read(4))')
elif [ "$DET" == "raxis_smv" ]; then
  echo "Data from a RAXIS detector with SMV header (dTREK image)"
  DETECTOR="RAXIS MINIMUM_VALID_PIXEL_VALUE=0"
  sed s/\;// tmp2 > tmp1
  mv tmp1 tmp2
  # find OVERLOAD
  SATURATED_VALUE=`grep SATURATED_VALUE tmp2 | head -1 | sed s/SATURATED_VALUE=//`
  DETECTOR="${DETECTOR}  OVERLOAD=${SATURATED_VALUE}"
  # find X_RAY_WAVELENGTH:
  X_RAY_WAVELENGTH=(`grep SOURCE_WAVELENGTH tmp2 | head -1 | sed s/SOURCE_WAVELENGTH=//`)
  X_RAY_WAVELENGTH=${X_RAY_WAVELENGTH[1]}
  # find NX,NY,QX,QY
  # NOTE that "RX_" may be different. probably we should check DETECTOR_NAMES= in header (RX_ is expected currently).
  # NX,NY should be read from RX_DETECTOR_DIMENSIONS?
  NX=`grep SIZE1 tmp2 | tail -1 | sed s/SIZE1=//`
  NY=`grep SIZE2 tmp2 | tail -1 | sed s/SIZE2=//`
  DET_SIZE=(`grep RX_DETECTOR_SIZE tmp2 | tail -1 | sed s/RX_DETECTOR_SIZE=//`)
  QX=`echo "scale=1; ${DET_SIZE[0]} / $NX" | bc -l`
  QY=`echo "scale=1; ${DET_SIZE[1]} / $NY" | bc -l`
  # find ORGX, ORGY
  SPATIAL_DISTORTION_INFO=(`grep RX_SPATIAL_DISTORTION_INFO tmp2 | tail -1 | sed s/RX_SPATIAL_DISTORTION_INFO=//`)
  ORGX=${SPATIAL_DISTORTION_INFO[0]}
  ORGY=${SPATIAL_DISTORTION_INFO[1]}
  # find DETECTOR_DISTANCE
  GONIO_NAMES=(`grep RX_GONIO_NAMES tmp2 | tail -1 | sed s/RX_GONIO_NAMES=//`)
  GONIO_VALUES=(`grep RX_GONIO_VALUES tmp2 | tail -1 | sed s/RX_GONIO_VALUES=//`)
  GONIO_UNITS=(`grep RX_GONIO_UNITS tmp2 | tail -1 | sed s/RX_GONIO_UNITS=//`)
  for i in `seq 1 ${#GONIO_NAMES[*]}`
  do
  idx=$((i-1))
  if [ "${GONIO_NAMES[$idx]}" == "Distance" ]; then
    DETECTOR_DISTANCE="-${GONIO_VALUES[$idx]}"
    # TODO: Check unit!! - ${GONIO_UNITS[$idx]}
  fi
  done
  # find OSCILLATION_RANGE
  ROTATION=(`grep "^ROTATION=" tmp2 | tail -1 | sed s/ROTATION=//`)
  OSCILLATION_RANGE=${ROTATION[2]}
  # NOTE: how can we know correct ROTATION_AXIS=?


elif [ "$DET" == "MAR345" ]; then
elif [ "$DET" == "MAR345" ]; then
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eof
eof
if [ "$DET" == "raxis" ]; then
if [ "$DET" == "raxis" -o "$DET" == "raxis_smv" ]; then
  cat >> XDS.INP << eof
  cat >> XDS.INP << eof
DIRECTION_OF_DETECTOR_X-AXIS=1 0 0
DIRECTION_OF_DETECTOR_X-AXIS=1 0 0
33

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