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CHANGELOG.md

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CCP4i2 Changelog

[2.2.4] - 2025-02-25

  • Fixed window maximising on Windows
  • ModelCraft used by default in the DR/MR/MB pipeline
  • Warning in the Refmac pipeline when validation fails
  • Updated neutron refinement options
  • Refmac/Servcalcat pipelines only providing X-ray data to validation
  • Observation type selection from CIF files in the import merged task
  • Hiding nanobind leak warnings from Gemmi 0.7
  • Changing Buccaneer to ModelCraft in the Phaser EP task
  • Fixed MrParse report on Windows

[2.2.3] - 2025-02-07

  • Fix Ramachandran plot
  • Fix for broken ASU contents
  • Fix embedded ModelCraft report

[2.2.2] - 2025-01-31

  • Fix to widgets loading a data file from the database
  • Fix to export imported files and project files with a job selection
  • Comparing models before and after refinement by Servalcat in Iris
  • Updates for gemmi 0.7

[2.2.1] - 2025-01-20

  • Updated ModelCraft control parameters
  • Refinement weighting text change
  • Fix missing Dummy DbApi entry for ARP/wARP
  • Disabling cryo-EM SPA refinement

[2.2.0] - 2025-01-14

  • New Servalcat refinement task
  • Fixes to Buster arguments
  • Fixed demo data path

[2.1.1] - 2025-01-10

  • Add log files, etc. to reports
  • Remove reference to 'manual' model building
  • Fix to report XML parsing
  • Fix to MTZ cell comparison
  • Fix running Lidia on Linux/Mac

[2.1.0] - 2024-12-13