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@sverhoeven sverhoeven released this 17 Jan 15:09
· 153 commits to master since this release

Library to interact with Kripo fragment, fingerprint and similarity data files.

KRIPO stands for Key Representation of Interaction in POckets, see reference for more information.

Added

  • Webservice endpoint to render 2D fragment in SVG
  • Published documentation on http://kripodb.readthedocs.io
  • Documented update pipeline
  • Documented command line interface in Sphinx
  • Retrieve fragments from webservice based on fragment id and pdb code (#35)

Changed

  • merge similarity pairs files in chunks instead of loading whole source file in memory
  • canned fragments_by_* methods can use local file or webservice
  • error when duplicate fragment insert is performed
  • Renamed kripodb similarities serve to kripodb serve, as it now also serves the fragments
  • Switched from nosetest to py.test (#36)