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v0.7.0: Merge pull request #35 from jonathanking/dev

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@jonathanking jonathanking released this 31 Jul 04:04
· 53 commits to master since this release
v0.7.0
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Learn about vigilant mode.
  1. Implements SCNDataset for easier data access (data = scn.load(... scn_dataset=True)).
  2. Implements SCNProtein for easier data manipulation (access attributes, etc.).
  3. Implements HydrogenBuilder. To add hydrogens to any coordinate set for a protein, simply use SCNProtein.add_hydrogens(). Note: the coordinate representation for the all-atom structure with hydrogens (SCNProtein.hcoords) does not include terminal-specific atoms (H2, H3, OXT). These are included in generated visualization/PDB file, but not in the coordinate set itself.

Please see the respective functions for more details.

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