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Move around cell 2 #358

Merged
merged 10 commits into from
Mar 16, 2023
Merged

Move around cell 2 #358

merged 10 commits into from
Mar 16, 2023

Commits on Mar 2, 2023

  1. Improve semantics of CELL category. 

        The CELL category parent is now DIFFRN.
    pressure, temperature items in CELL_MEASUREMENT deprecated
    in favour of similar items in DIFFRN.

    Pointers to _diffrn.id added to CELL etc. to allow multiple
    cells to be presented where multiple diffraction
    conditions are used.

    The `CELL_MEASUREMENT` category now has two `_diffrn.id` pointers, one to
    specify the data collection to which the cell measurement applies, and
    one to the conditions under which the cell was measured (`.condition_id`).
    Normally these coincide and the latter is not necessary, but legacy point
    detector experiments can sometimes involve measuring the cell under
    differing conditions prior to data collection.
    James.Hester committed Mar 2, 2023
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  2. Fixed layout order after previous changes.

    James.Hester committed Mar 2, 2023
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Commits on Mar 12, 2023

  1. Add example files that illustrate the new way of recording cell measu… 

    …rements

conditions.
    @vaitkus
    vaitkus committed Mar 12, 2023
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Commits on Mar 15, 2023

  1. Add warning about presenting merged blocks

    @jamesrhester
    jamesrhester authored Mar 15, 2023
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  2. Explain why cell_measurement items might appear twice

    @jamesrhester
    jamesrhester authored Mar 15, 2023
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  3. Add an example file that uses the deprecated CELL_MEASUREMENT items.

    @vaitkus
    vaitkus committed Mar 15, 2023
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  4. Rename one of the example files.

    @vaitkus
    vaitkus committed Mar 15, 2023
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  5. Relate the multi-block example file to the new single block example f… 

    …ile.
    @vaitkus
    vaitkus committed Mar 15, 2023
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  6. Add the _definition_replaced.id attributes to satisfy the validator.

    @vaitkus
    vaitkus committed Mar 15, 2023
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Commits on Mar 16, 2023

  1. Delete cell-measurement-merged-block.cif. 

    The file is no longer relevant as an example.
    @vaitkus
    vaitkus authored Mar 16, 2023
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