Version 3 (modified by 2 years ago) ( diff ) | ,
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Phenix
- Command version of fit_loops
- Sent test case showing 4-processor version 5x slower than one processor
- Immediate to-dos:
- Work up test case for fit_loops failing on 2gtk due to residue numbering
- Document needs for JSON output from fit_loops
- Randy Read added full-map-only mode for voyager.emplace_local; need to update fit-in-map tool
ChimeraX completed
- Build Structure
- Adjust Torsions (also in selection context menu)
- Adjust Angles
- Handle Mol2 files that have GAFF types
- Charge computation falls back to more reliable method if faster method fails (courtesy Tristan)
- 'Info' commands can save to file
- Matchmaker
- More reliably switch to 'sensible' similarity scoring matrix
- 'reportMatrix' option
- Made hiding/closing of large numbers of models faster
- Override Strucure 'display' attribute rather than use CLOSE_MODELS trigger
- Batch updating of collections
- Fixed memory leaks
- Metadata dict keys/values
- Residues.unique_sequences list append
- Drawing code holding references to pseudobond groups (not a leak per se)
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