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Commits on Apr 17, 2023

• fix chain selection in tutorial notebook

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• Merge branch 'tensor_fixes' of https://www.github.com/a-r-j/graphein into tensor_fixes

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• fix chain selection in tests

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• [pre-commit.ci] auto fixes from pre-commit.com hooks

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• remove unused verbosity arg

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• [pre-commit.ci] auto fixes from pre-commit.com hooks

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• refactor chain selection

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• improve insertion and non-standard residue handling

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• add PSW to nonstandard residues

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Commits on Apr 16, 2023

• Consistent conversion to undirected graphs (#301)

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Commits on Apr 11, 2023

• remove rogue print statement (#302)

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Commits on Apr 10, 2023

• update workflow version

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• update version for 1.7.0

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• Add autopublish workflow (#298)

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Commits on Apr 7, 2023

• Prep for 1.7.0 release (#292)

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Commits on Apr 6, 2023

• Support MMTF & rename pdb_path to path throughout (#293)

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Commits on Mar 31, 2023

• Development of PDBManager Class (WIP) (#272)

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Commits on Mar 27, 2023

• Update citation (#287)

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• FoldComp ML Datasets (#284)

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Commits on Mar 18, 2023

• changes for 1.6.0 (#279)

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Commits on Mar 14, 2023

• Minor patch convert_nx_to_pyg #280 (#281)

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Commits on Mar 12, 2023

• Df processing #216 (#222)

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Commits on Mar 11, 2023

• Improve altloc handling (#263)

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• Switch to miniconda for build (#278)

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• prelim path support #269 (#277)

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• clean up unused files and move docs from root (#276)

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• Add improved error message for non standard node funcs #274 (#275)

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Commits on Feb 21, 2023

• Fix graph sequence (atomistic graphs in initialise_graph_with_metadata had duplicated residues) (#268)

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Commits on Feb 13, 2023

• add graph construction from a dataframe (#264)

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Commits on Feb 10, 2023

• Fix and improve the utilities for PyG (#234)

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Commits on Feb 9, 2023

• [pre-commit.ci] pre-commit autoupdate (#260)

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Commits on Jan 31, 2023

• [pre-commit.ci] pre-commit autoupdate (#257)

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• Fix typo in problematic_pdbs.rst (#258)

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Commits on Jan 30, 2023

• Add tensor parsing util (#244)

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Commits on Jan 26, 2023

• fix peptide bonds for all atom graphs (#254)

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