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CHANGELOG.md

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Release 0.6.6.0 Changes (from 0.6.2.0):

  • Now explicitly invoking python2, instead of python to avoid python version conflicts.
  • General script: run_xds2staraniso.sh for runing staraniso from an XDS_ASCII.HKL or XSCALE.HKL file. XDSME
  • Fix usage info
  • Verifying the mean backgroud level from DEFPIX step to eventually fix scale factors in integrate step if starting after INIT step.
  • Removed the limitation on maximum number of proc. Let xds_par decide.
  • Set default MAXIMUM_NUMBER_OF_JOBS to 1
  • Bug fix for catching critical errors in run_idxref XIO
  • Improved handling of Dectris Eiger HDF5 file format.
  • Fixing bugs in the miniCBF beam_XY value extraction with hdf2mini-cbf
  • Forcing GAIN= 1. in XIO xds export for all Eiger and Pilatus detector frames. XUPY
  • Completing the SPGlib for some centrosymmetric spacegroups

Release 0.5.9.1 Changes: XDSME

  • new option: --optimized --O[1-3]
  • new option: --E --exec
  • added XDS_PATH env. variable.
  • Fix bug for calling option --ice
  • Fix bug for calling option --project XDSCONV
  • force option -a (anomalous difference output) to be the default.
  • added -o option to define output file names.
  • fixe run_phaser.sh script for default HKLOUT name.
  • added XDS_PATH env. variable. XSCALE2
  • added option -z
  • cleaning dead code XIO
  • Correct MSC ccd header interpretation for spindle orientation. XUPY
  • Change for XDS_PATH env. variable.