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Releases: paulsbond/modelcraft

v5.0.1

28 Nov 12:26
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Changed

  • Gemmi fractionalization_matrix to frac.mat and orthogonalization_matrix to orth.mat.

v5.0.0

08 Nov 14:30
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Added

  • EM --half-maps, --single-map and --build-map arguments.

Changed

  • EM --mask argument default to None with 'auto' as an option for EMDA mapmask.

Removed

  • EM --map and --blur arguments.

v4.0.2

24 Oct 16:15
d426909
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Fixed

  • Crash when no residues are built.

v4.0.1

14 May 11:57
22c80d0
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Fixed

  • Monomer library groups when a residue name is not in the library

v4.0.0

18 Mar 09:36
9f7c1ce
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Removed

  • Coot RSR morph

v3.6.0

13 Mar 15:52
6c6ce53
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Changed

  • X-ray pipeline to run Buccaneer and Nautilus separately and combine the results
  • Reporting numbers of protein and nucleic acid residues

v3.5.3

04 Mar 17:39
b70723d
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Fixed

  • Dummy atoms are now oxygen atoms instead of sodium atoms

v3.5.2

16 Feb 16:11
03bc82d
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Changed

  • Output MTZ file to be the same as HKLOUT from the Refmac job

v3.5.1

18 Jan 20:00
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Changed

  • Water chain naming to try to be compatible with PDB format

v3.5.0

09 Jan 15:04
706bc31
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Added

  • Option --threads to allow Buccaneer to use multiprocessing