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pyemap-1.0.2

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@gayverjr gayverjr released this 30 Sep 17:49
8e9ad38

Minor update

Bug fixes

  • Fixed divide by zero error which caused errors when a protein had standard residues lacking side chain atoms. Such residues are now removed from the graph and a warning is displayed
  • Non-Side chain atoms are no longer removed from consideration during residue depth calculations, which improves accuracy of solvent exposure criterion

Compatibility notes

  • More explicit warnings are included for issues with Mac OS Catalina and MSMS
  • Error message from newer RDKit is suppressed