Thursday 26 July 2007

Developments towards 0.2.6.1

The following features are pencilled in for xia2 0.2.6.1 -

- Better XDS support
- More careful elimination of autoindex solutions
- Inclusion of a reference reflection file (must be MTZ, containing I's)

The latter is to use for setting standard indexing, spacegroup (if pointgroup is compatible) and FreeR flags. Useful when you want to refine an existing data set against newly processed data.

More information on progress and details will be posted here.

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