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Releases: ccp4/ccp4i2

v2.5.2

09 Feb 15:19
84a8d0b

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  • Xia2 DIALS only supports image directory on Windows
  • Testing AceDRG atom IDs do not contain spaces

v2.5.1

05 Feb 17:32
2c426e5

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  • Fix to spaces/quoting in AceDRG atom name matching

v2.4.3

29 Oct 14:37
f1ed8b1

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  • Improved checking/rebuilding of database and project-list XML files on startup

v2.4.2

23 Oct 10:31
444bf22

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  • Capturing stderr for subjobs in Refmac, Servalcat and Lorestr pipelines
  • Reducing size of reports by fetching log files instead of embedding them
  • Fix for reflection CIF files containing both merged and unmerged data
  • New Pointless options to remove lattice centering reflections
  • Fix to Servalcat report type handling
  • Fixes to i2run testing

v2.4.1

17 Oct 09:58
9a53683

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  • Fix Coot map coluring with multiple models
  • Fix for AceDRG atom name matching
  • Improved graphs in Servalcat report
  • Added checks before xmlnode append
  • Searching Python 3.11 paths for CCP4 10
  • PDB-REDO text change

v2.4.0

06 Aug 10:21
5e8d8a5

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  • Servalcat refinement against unmerged data
  • Servalcat option for van der Waals restraint weight
  • Updated Iris validation to work with v0.3.3
  • More graphs in the Servalcat report
  • More Servalcat i2 run tests
  • Fix for deprecated numpy.float
  • More AceDrg i2run tests
  • Support for 5-letter ligand codes in AceDRG make link

v2.3.3

30 May 09:08
48aaed9

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  • Fix to Coot output files

v2.3.2

22 May 14:59
a4c2590

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  • Avoid re-importing files with the same checksum
  • Fix for the Coot RSR Morph task on Windows
  • Fixed collections.Iterable import
  • Changed some performance testing thresholds

v2.3.1

19 May 12:23
88f2b03

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  • Changed some performance testing thresholds
  • Removed unused CCP4I2Runner code
  • Removed deprecated collections imports

v2.3.0

14 May 10:51
10c4c86

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  • Added a Coot 1 task
  • Added a MetalCoord task
  • Added performance testing to the i2run tests
  • Fix to AUSPEX command line for Windows
  • Fix for ASU contents view with QtGui/QtWidgets changes