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@jamesmkrieger jamesmkrieger released this 08 Apr 10:24
v2.1.0
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Learn about vigilant mode.

2.1.0 (April 8, 2022)

New Features:

Integration with Scipion

  • New functions :function:.parseScipionModes, :function:.writeScipionModes
    and :function:.calcScipionScore

  • New argument --export-scipion (-S) in prody apps

Other

  • Added :function:.assignBlocks for assigning blocks for RTB

  • Added mmCIF header parsing to create the same header dictionary as PDB header,
    including secstr information and biomolecular assembly building

  • New arguments for prody apps, including altloc, zeros, sparse, kdtree and turbo

Bug Fixes and Improvements:

  • Improvement to cealign mapping to be faster for protein only alignment

  • Bug fix for writing psf files

Full Changelog: v2.0.2...v2.1.0

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