Repository navigation
Commit a4366bb
authored
Complete the bundled space-group database (#187)
* Add space-group-database ADR suggestion
* Add space-group-database implementation plan
* Add cctbx-based space-group table extraction
* Add multi-source cross-check and disagreement report
* Generate initial space-group disagreement report
* Localize space-group curation artifacts
* Move crysview demo to subdirectory
* Add curated space-group overrides
* Generate complete space_groups.json.gz with recorded provenance
* Load space groups from JSON and drop restricted unpickler
* Reach Phase 1 review gate
* Cover public space-group coordinate aliases
* Add space-group database ADR index row
* Add Phase 2 space-group database tests and packaging check
* Apply pixi run fix auto-fixes
* Alias runtime coordinate codes in space-group database
* Apply prettier formatting to space-group-database ADR
* Make packaging check inspect the wheel directly
* Unify Plotly tooltip styling and fix white Bragg hover
* Guard optional IPython import in table backend base
* Pin space-group record count in tests and wheel check
* Update Plotly hover test and fix overlong comment
* Update tutorial links to latest docs
* Add Wyckoff letter detection ADR1 parent 2d46651 commit a4366bb
23 files changed
Lines changed: 3024 additions & 239 deletions
File tree
- docs
- dev
- adrs
- accepted
- crysview-structure-visualization
- suggestions
- space-group-database
- package-structure
- plans
- docs/tutorials
- src/easydiffraction
- crystallography
- display
- plotters
- tablers
- tests/unit/easydiffraction
- crystallography
- display
- plotters
- tablers
- tools
| Original file line number | Diff line number | Diff line change | |
|---|---|---|---|
| |||
22 | 22 | | |
23 | 23 | | |
24 | 24 | | |
25 | | - | |
26 | | - | |
| 25 | + | |
| 26 | + | |
27 | 27 | | |
28 | 28 | | |
29 | 29 | | |
| |||
Large diffs are not rendered by default.
Large diffs are not rendered by default.
Large diffs are not rendered by default.
Large diffs are not rendered by default.
| Original file line number | Diff line number | Diff line change | |
|---|---|---|---|
| |||
| 1 | + | |
| 2 | + | |
| 3 | + | |
| 4 | + | |
| 5 | + | |
| 6 | + | |
| 7 | + | |
| 8 | + | |
| 9 | + | |
| 10 | + | |
| 11 | + | |
Large diffs are not rendered by default.
| Original file line number | Diff line number | Diff line change | |
|---|---|---|---|
| |||
263 | 263 | | |
264 | 264 | | |
265 | 265 | | |
266 | | - | |
267 | 266 | | |
268 | 267 | | |
269 | 268 | | |
| |||
Large diffs are not rendered by default.
0 commit comments