Release Notes
- Added difference map calculation for cryoEM (as implemented in Servalcat)
- Added a GFN-xTB engine (xtb_manager) for quantum-mechanics restraints
- Improvements to reduce2 hydrogen placement (with a reduce1/reduce2
- Added iotbx.file_io for single-parse file reading, with xz/lzma/zstd
Checksums
SHA256
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b838b6122eb1b64588d08b6e91da7435440af1a04460919c3efb4c4afe88fc93 chem_data-2026.6-pyhbfd0f4e_0.conda