Xdscc12: Difference between revisions

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106 bytes added ,  14 December 2016
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The program can be downloaded for [ftp://turn5.biologie.uni-konstanz.de/pub/xdscc12.rhel6.64 Linux 64bit] or [ftp://turn5.biologie.uni-konstanz.de/pub/xdscc12-mac Mac].
The program can be downloaded for [ftp://turn5.biologie.uni-konstanz.de/pub/xdscc12.rhel6.64 Linux 64bit] or [ftp://turn5.biologie.uni-konstanz.de/pub/xdscc12-mac Mac].


Usage (this text can be obtained with xdscc12 -h):
Usage (this text can be obtained with <code>xdscc12 -h</code>):
<pre>
<pre>
usage: deltacc12 -dmin <lowres> -dmax <highres> -nbin <nbin> -mode <1 or 2> -<abcdeftwz> FILE_NAME
usage: xdscc12 -dmin <lowres> -dmax <highres> -nbin <nbin> -mode <1 or 2> -<abcdeftwrz> FILE_NAME
dmax (default 999A), dmin (default 1A) and nbin (default 10) have the usual meanings.
dmax (default 999A), dmin (default 1A) and nbin (default 10) have the usual meanings.
mode can be 1 (equal volumes of resolution shells) or 2 (increasing volumes; default).
mode can be 1 (equal volumes of resolution shells) or 2 (increasing volumes; default).
   -t: total oscillation (degree) to batch fine-sliced frames into
   -t: total oscillation (degree) to batch fine-sliced frames into
  -r: also show CC against reference dataset (e.g. Icalc from model)
other options can be combined (e.g. -def), and switch the following off:
other options can be combined (e.g. -def), and switch the following off:
   -a: individual isomorphous summary values
   -a: individual isomorphous summary values
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The program output is terse but supposed to be self-explanatory. Part of it is most easily visualized via XDSGUI, however, that currently deals with the isomorphous signal of a batch of frames (width chosen with the -t option) relative to all data.
The program output is terse but supposed to be self-explanatory. Part of it is most easily visualized via XDSGUI, however, that currently only deals with the isomorphous signal of a batch of frames (width chosen with the -t option) relative to all data.


For multiple datasets, the output lines show the contribution of each dataset toward the total CC<sub>1/2</sub>. Negative numbers indicate a worsening of the overall signal.
For multiple datasets, the output lines show the contribution of each dataset toward the total CC<sub>1/2</sub>. Negative numbers indicate a worsening of the overall signal.


All statistics are given for the isomorphous and the anomalous signal.
Statistics are given (in resolution shells) for the isomorphous and the anomalous signal.
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