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biojava
biojava-structure
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Commits on Sep 22, 2015
Fixed DBRef#toPDB() method to give 80 characters line
sroughley
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Modified PBBFileParser to ensure all lines are 80 chars prior to parsing
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Commits on Sep 18, 2015
Modified StructureTools#getGroupsWithinShell method to return a Set not
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Commits on Sep 17, 2015
cleanup
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#326 test for issue and fix
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Commits on Sep 16, 2015
Removing warnings.
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don;t use Java 8 specific method names
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work around if ReducedChemCompProvider is getting used
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adding support for parsing sequence mismatched into Chain class
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additional test for parsing SIFTs files
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Commits on Sep 15, 2015
Fix #321. Optimized completeGroup() for large groups.
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Commits on Sep 14, 2015
Use random seed unless specified in CeSymm optimization
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Method to get the principal axis index from a RotationGroup
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Fix bug when an empty alignment is produced in CeSymm
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Commits on Sep 11, 2015
Merge branch 'master' of github.com:biojava/biojava
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#322 starting to add support for struct_ref_seq_dif category
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Fix ArrayIndexOutOfBounds due to iterating over too-short proteins
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Commits on Aug 28, 2015
#320 updating API
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#320 updating API
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Commits on Aug 14, 2015
Bond and SSBond now implemented as interfaces backed by BondImpl and SSBondImpl, respectively.
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Merge pull request #318 from sbliven/master
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Merge branch 'itasser'
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Change logger messages of CeSymm to info level
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Fix NullPointer bug in CeSymm
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Add all scores to non-optimized symmetry results
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Commits on Aug 13, 2015
Fix small bug with short non-symmetric alignments
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Fix bug when result was not symmetric in CeSymm
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Disallow MC optimization in parallel
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Method to clone parameters in CeSymm
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Commits on Aug 12, 2015
Port two tests for internal symmetry package
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Improve symmetry error messages
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Check for symmetry significance in MultipleAlignment
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Add new parameter for distance cutoff to MC optimization
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Commits on Aug 11, 2015
Fix bug in CeSymm iteration process
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Add demo for point group internal symmetry calculation
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