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Fix CIF parser for awkward linebreaks #61

Merged
merged 4 commits into from
Jun 7, 2020
Merged

Fix CIF parser for awkward linebreaks #61

merged 4 commits into from
Jun 7, 2020

Commits on Jun 7, 2020

  1. FIX: updated cif reader to handle awkward line breaks

    @ml-evs
    ml-evs committed Jun 7, 2020
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  2. FIX: also scrape _space_group_symop_operation_xyz as alternate sym op… 

    … key
    @ml-evs
    ml-evs committed Jun 7, 2020
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  3. ENH: added --save_res flag to pxrd_calculator to compare matadors rep… 

    …resentation of the structure with the input cif
    @ml-evs
    ml-evs committed Jun 7, 2020
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  4. MAINT: added help strings for all pxrd_calculator flags

    @ml-evs
    ml-evs committed Jun 7, 2020
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