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Generate XDS.INP: Difference between revisions
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Olibclarke (talk | contribs) (xds_graph.sh will now run xdsstat, if available, and display Rmeas and Rd per image.) |
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# revision 0.26 Oliver Clarke 10/12 - Added generation of shell scripts for conversion to MTZ and visualisation of statistics. Other minor alterations to XDS.INP. | # revision 0.26 Oliver Clarke 10/12 - Added generation of shell scripts for conversion to MTZ and visualisation of statistics. Other minor alterations to XDS.INP. | ||
# revision 0.27 Oliver Clarke 10/12 - xds_graph.sh will now run xdsstat, if available, and plot Rmeas and Rd per image. | # revision 0.27 Oliver Clarke 10/12 - xds_graph.sh will now run xdsstat, if available, and plot Rmeas and Rd per image. | ||
REVISION="0. | # revision 0.28 Oliver Clarke 10/12 - xds_graph was not plotting h00, 0k0, 00l reflections when a reference dataset was present. Fixed. | ||
REVISION="0.28 (20-Oct-2012)" | |||
# | # | ||
# usage: e.g. xds_generate_all "frms/mydata_1_???.img" | # usage: e.g. xds_generate_all "frms/mydata_1_???.img" | ||
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\\$\\$ \\$\\$ | \\$\\$ \\$\\$ | ||
\" | \" | ||
awk '/REFLECTIONS OF TYPE H/,/ | awk '/REFLECTIONS OF TYPE H/,/COMP/' CORRECT.LP | egrep \"[1-9]\" | awk '{print \$1,\$2,\$3,\$4,\$7,\$8}' | awk '(\$1 > 0)' | ||
echo \"\\$\\$\" | echo \"\\$\\$\" | ||
| Line 957: | Line 958: | ||
\\$\\$ \\$\\$ | \\$\\$ \\$\\$ | ||
\" | \" | ||
awk '/REFLECTIONS OF TYPE H/,/ | awk '/REFLECTIONS OF TYPE H/,/COMP/' CORRECT.LP | egrep \"[1-9]\" | awk '{print \$1,\$2,\$3,\$4,\$7,\$8}' | awk '(\$2 > 0)' | ||
echo \"\\$\\$\" | echo \"\\$\\$\" | ||
| Line 966: | Line 967: | ||
\\$\\$ \\$\\$ | \\$\\$ \\$\\$ | ||
\" | \" | ||
awk '/REFLECTIONS OF TYPE H/,/ | awk '/REFLECTIONS OF TYPE H/,/COMP/' CORRECT.LP | egrep \"[1-9]\" | awk '{print \$1,\$2,\$3,\$4,\$7,\$8}' | awk '(\$3 > 0)' | ||
echo \"\\$\\$\" | echo \"\\$\\$\" | ||