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Version 3.2.1
- Fix bondmap to use the correct compound factory
Version 3.2.0
- New way of loading dictionaries, passing data to cifpp
if not known.
Version 3.1.5
- Fix usage specification of Eigen3
Version 3.1.4
- Fix example code
Version 3.1.3
- Removed some compiler warnings
- Updated libcifpp dependency
Version 3.1.2
- Changes required to build on Windows
Version 3.1.1
- Fix masking of maps in MapMaker
Version 3.1.0
- Added TLS code (moved from libcifpp)
Version 3.0.7
- New version string code
Version 3.0.6
- Fix in calculating symmetry atom locations
Version 3.0.5
- Refinement work
- Fix regression in bondmap voor sugars
Version 3.0.4
- Changes for packaging
Version 3.0.3
- Based on new libcifpp
Version 3.0.2
- Fix error in statistics calculation for atoms
with an occupancy lower than 1.
Version 3.0.1
- Fix error in sampling rate when recalculating maps
Version 3.0.0
- Real space refinement update
- Fix reading from maps instead of mtz
Version 2.0.4
- Better real space refinement engine
- bug fixes
Version 2.0.3
- Fix version number, sorry.
Version 2.0.2
- Changed more signatures to use std::filesystem::path
instead of std::string. To ease compilation on MSVC
Version 2.0.1
- Fix math problem, on some system combinations abs(x) would
first truncate x to an integer. Replacing with std::abs(x)
restores normal behaviour.
Version 2.0.0
- Updated build configuration
- removed bzip2 support
Version 1.1.0
- Now with cmake instead of GNU configure
Version 1.0.0
- First public release as a split-out library
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