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@jboes jboes released this 20 Apr 18:55
· 199 commits to master since this release
v0.3.0
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Learn about vigilant mode.

Refactoring of CatKit into the general modules (Gratoms) and the generator functionality, CatGen.

  1. The first implementation of the Builder class (not tests)
  • Need to include a more flexible enumeration of non-symmetric sites.
  1. Molecule generation module to assist the user in creation of topological structures of small molecules.
Assets 2