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REBATCH (CCP4: Supported Program)NAMErebatch - alter batch numbers and other batch information in an unmerged MTZ file (saves re-running Mosflm).SYNOPSISrebatch HKLIN foo_in.mtz HKLOUT foo_out.mtz[Keyworded input] DESCRIPTIONA program to alter batch numbers in an unmerged MTZ file. This may be necessary to give different batches number to all your MTZ files (saves running Mosflm again).If datasets are defined in the header, or if BATCH PNAME & DNAME commands are given, then the dataset cell dimension and wavelength properties will be checked and reset if necessary. This allows the file to be fixed up if these properties have not been properly set by eg Mosflm. Priority for setting the dataset cell & wavelength is:-
The program will also patch the detector limits in the batch headers.These are needed for the detector scaling options in Scala. KEYWORDED INPUTThe various data control lines are identified by keywords. Only the first 4 letters of each keyword are necessary. Most keywords are optional. BATCH, TITLE, HISTORY, DETECTOR, CELL, WAVELENGTH, ENDBATCH <batch_range | batch_list | ALL> ADD <nadd> | START <nstart> | REJECT | INCLUDE | MAXWIDTH | PNAME <projectname> DNAME <datasetname>Define batch number editing for either a range of batches (b1 TO b2), a list of batches ( b1 b2 b3 ...), or ALL [default].Editing options are: Only one editing option can be given for each BATCH command (apart from PNAME and DNAME, which should be given together), but a series of BATCH commands may be given, and have a cumulative effect.
TITLE <title>New title for file HKLIN, to be put in main MTZ header.
HISTORY <history>New history record for file HKLIN.
DETECTOR <xmin> <xmax> <ymin> <ymax>Reset limits of detector coordinates XDET, YDET for all batches. These are needed for the detector scaling options in Scala.
CELL <a> <b> <c> <alpha> <beta> <gamma>Reset cell dimensions for the file header and all datasets. Batch cell dimensions are not altered.
WAVELENGTH <lambda>Reset wavelength for all datasets. Batch wavelengths are not altered.
ENDEnd keyworded input. EOF will also work.SEE ALSOscalaEXAMPLES A unix example file is available on $CEXAM/unix/runnable/
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