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@wojdyr wojdyr released this 02 Jun 14:25
· 1309 commits to master since this release
  • determining lattice symmetry and (psuedo-)merohedral twinning laws
  • added GroupOps::derive_symmorphic() and GroupOps::add_inversion()
  • getting change-of-basis in the Niggli reduction
  • added transform_to_assembly() – it does a bit more than make_assembly()
  • removed Op::negated()
  • python: add bindings to UnitCell.orth and UnitCell.frac
  • additional options in gemmi-mtz2cif and gemmi-cif2mtz
  • bug fixes (in Ccp4::set_extent(), merge_atoms_in_expanded_model(), status column in mtz2cif)