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openstructure
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74ba9aa5ddc1f8205250c8ebcecd6480b232f8d6
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mmtf
no_boost_filesystem
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doc: document BondHandle
fix: enable passing by argument (makes documentation easier)
refactor: add common properties of other handles
doc: there is no 'other' property (not possible)
feat: SCHWED-5783 add networkx dependency
feat: SCHWED-5783 don't rename/renumber ligands
doc: add ligand_scoring to online doc
doc: fix error message
fix: SCHWED-5783 update only if used
test: SCHWED-5783 activate tests in make check
Merge branch 'develop' into ligand_scoring
fix: copy chain type and description in Copy()
feat: SCHWED-5783 skeleton for ligand scoring
feat: SCHWED-5783 accept ligands as input
Merge branch 'develop' into ligand_scoring
fix: copy chain type and description in Copy()
dont remove non standard res
OMF: add name property to OMF format
OMF: optimize secondary structure compression
feat: SCHWED-5783 skeleton for ligand scoring
doc: warning about is_ligand
OMF: add file required in unit tests
OMF: expose internal data without requirement of constructing ost EntityHandle
OMF: enable CA-only OMF
OMF: store chain type (POLY, NON_POLY etc.)
OMF: make version available
OMF unit tests
transfer ChemType property in PDBize
Improve compression in OMF
Load mmcif from strings
scoring bugfix
scoring.py bugfix
bugfix
scoring: add interface patch scores
stereocheck: extend unit tests
stereocheck: docu updates
stereochemistry unit tests
stereochemistry unit tests
Correct naming in hardcoded stereochemistry parameters
Explicitely strip " from atom names for stereochemistry param
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