Version 1.7.6

OESystem 1.7.6

Major bug fixes

  • Internal debugging mechanism was left on in the previous release. This version turns it off improving performance across all libraries.

OEBio 1.7.6

Minor bug fixes

  • As long as the OEAssumption::BondedResidue flag is turned off, OEGetResidueAtoms now correctly returns an iterator for every atom in a residue when some atoms in the residue are not connected to others.
  • Because some crystal symmetry space-groups share the same space-group number which can lead to the use of the wrong space group operators, when possible the name of the symmetry is now used rather than the space group number.