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@jamesmkrieger jamesmkrieger released this 19 May 10:14
v2.2.0
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2.2.0 (May 19, 2022)

Bug Fixes and Improvements:

  • Updates to :function:`.parseScipionModes`` to use sqlite and xmd metadata files
    and handle eigenvalues

  • Actual fix to logging so LOGGER.progress doesn't override logging level

  • Updates to the PCA app to better handle number of modes for Scipion

  • New arguments sparse, kdtree and turbo for :class:.ClustENM, allowing
    better control of ANM calculations.

  • Another bug fix for mmCIF header parsing

  • Bug fix for parsing CONECT bond records from PDB files

Full Changelog: v2.1.2...v2.2.0

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