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openstructure
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96153780822aec7af7c0b0f07832e5a97f525403
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mmtf
no_boost_filesystem
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mmcif writer: clarify error message for insertion codes
mmcif writer: clarify error message for negative residue numbers
mmcif writer: Don't write loops that contain no data
Fail cleanly for gaps in unknown polymer chain types
mmcif writer: dont ask
mmcif writer: export raw star writer functionality
mmcif writer: bugfix
mmcif writer: refactor
Minimal support for oligosaccharides
fix: pdb author resnum/insertion code in atom_sites
mmcif writer: Use controlled vocabulary for _chem_comp.type
Improve error message
mmcif writer: resolve linking errors for certain usages of ChemClass
fix DeprecationWarning warning about invalid escape sequence
mmcif writer: bugfix
mmcif writer: treat gaps of unknown residues in SEQRES
mmcif writer: refactor
mmcif writing: refactor
mmcif writer: Make entity info a property of mmcif writer
mmcif writer: rename SetEntity to SetStructure
mmcif writer: resnum based entity matching, even if atomseq differs
doc: SCHWED-6088 add note on data items requirements
mmcif writer: read chain type from ost.mol.ChainHandle.GetType property
fix: SCHWED-6070 cleanup Deuteriums too
Merge branch 'master' into develop
Merge branch 'release-2.6.0'
2.6.0
2.6.0
fix: TypeError in Resize(): expects int.
mmcif writing: make mmCIFify optional
mmcif writing: improve automated detection of _entity.type/_entity_poly.type
logging: SCHWED-6088 give more details about the problem
Merge branch 'release-2.6.0' into develop
doc: add LoadSDF (old) and SaveSDF (new)
feat: add a function to save an SDF file directly
bugfix in mol.alg.scoring
mmcif writer: add attributes to _entity_poly category
fix: fail early and clearly with quote chain names
fix: special characters are allowed in chain names
fix: SCHWED-6088 make auth_seq_id and pdbx_PDB_ins_code more optional
mmcif writer: produces first valid mmcif files!
Fix output dir of Doxygen to build dir
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