ihmwg / python-modelcif

Python package for handling ModelCIF mmCIF and BinaryCIF files
MIT License
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Add support for associated files #3

Closed benmwebb closed 2 years ago

benmwebb commented 2 years ago

Allow writing some categories out to different file(s) and link them from the main file in ma_entry_associated_files. On read, optionally read in associated files and parse them as mmCIF if requested. Main use case here is likely the pairwise local QA metrics used in AlphaFold models.

We may be able to leverage some of the code from python-ihm here that is currently used for handling datasets (the Location and Repository classes in location.py).