Updates to CIF preparation post grid search#103

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marcuscollins wants to merge 6 commits intomainfrom

patch-cif-updates

Commits on Feb 25, 2026

Changes to CIF patching script: 1/ set the seq id to what it is in the original pdb; 2/ include occ and B-factor columns 3/ write to a file refined-patched.cif instead of backing up the original
marcuscollins
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Commits on Feb 26, 2026