essreduce 25.12.0__tar.gz → 26.1.0__tar.gz

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Files changed (149) hide show
  1. {essreduce-25.12.0 → essreduce-26.1.0}/PKG-INFO +1 -1
  2. {essreduce-25.12.0 → essreduce-26.1.0}/docs/user-guide/tof/dream.ipynb +7 -7
  3. {essreduce-25.12.0 → essreduce-26.1.0}/docs/user-guide/tof/frame-unwrapping.ipynb +6 -6
  4. {essreduce-25.12.0 → essreduce-26.1.0}/docs/user-guide/tof/wfm.ipynb +4 -4
  5. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/base.txt +1 -1
  6. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/basetest.txt +1 -1
  7. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/nexus/workflow.py +8 -6
  8. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/normalization.py +154 -26
  9. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/time_of_flight/__init__.py +4 -0
  10. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/time_of_flight/eto_to_tof.py +26 -10
  11. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/time_of_flight/lut.py +5 -5
  12. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/time_of_flight/types.py +9 -2
  13. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/time_of_flight/workflow.py +5 -5
  14. {essreduce-25.12.0 → essreduce-26.1.0}/src/essreduce.egg-info/PKG-INFO +1 -1
  15. {essreduce-25.12.0 → essreduce-26.1.0}/tests/nexus/workflow_test.py +119 -6
  16. {essreduce-25.12.0 → essreduce-26.1.0}/tests/normalization_test.py +43 -0
  17. {essreduce-25.12.0 → essreduce-26.1.0}/tests/time_of_flight/lut_test.py +4 -4
  18. {essreduce-25.12.0 → essreduce-26.1.0}/tests/time_of_flight/unwrap_test.py +3 -9
  19. {essreduce-25.12.0 → essreduce-26.1.0}/tests/time_of_flight/wfm_test.py +1 -3
  20. {essreduce-25.12.0 → essreduce-26.1.0}/tests/time_of_flight/workflow_test.py +76 -11
  21. {essreduce-25.12.0 → essreduce-26.1.0}/tox.ini +3 -3
  22. {essreduce-25.12.0 → essreduce-26.1.0}/.copier-answers.ess.yml +0 -0
  23. {essreduce-25.12.0 → essreduce-26.1.0}/.copier-answers.yml +0 -0
  24. {essreduce-25.12.0 → essreduce-26.1.0}/.github/ISSUE_TEMPLATE/high-level-requirement.yml +0 -0
  25. {essreduce-25.12.0 → essreduce-26.1.0}/.github/dependabot.yml +0 -0
  26. {essreduce-25.12.0 → essreduce-26.1.0}/.github/workflows/ci.yml +0 -0
  27. {essreduce-25.12.0 → essreduce-26.1.0}/.github/workflows/docs.yml +0 -0
  28. {essreduce-25.12.0 → essreduce-26.1.0}/.github/workflows/nightly_at_main.yml +0 -0
  29. {essreduce-25.12.0 → essreduce-26.1.0}/.github/workflows/nightly_at_main_lower_bound.yml +0 -0
  30. {essreduce-25.12.0 → essreduce-26.1.0}/.github/workflows/nightly_at_release.yml +0 -0
  31. {essreduce-25.12.0 → essreduce-26.1.0}/.github/workflows/python-version-ci +0 -0
  32. {essreduce-25.12.0 → essreduce-26.1.0}/.github/workflows/release.yml +0 -0
  33. {essreduce-25.12.0 → essreduce-26.1.0}/.github/workflows/test.yml +0 -0
  34. {essreduce-25.12.0 → essreduce-26.1.0}/.github/workflows/unpinned.yml +0 -0
  35. {essreduce-25.12.0 → essreduce-26.1.0}/.github/workflows/weekly_windows_macos.yml +0 -0
  36. {essreduce-25.12.0 → essreduce-26.1.0}/.gitignore +0 -0
  37. {essreduce-25.12.0 → essreduce-26.1.0}/.pre-commit-config.yaml +0 -0
  38. {essreduce-25.12.0 → essreduce-26.1.0}/.python-version +0 -0
  39. {essreduce-25.12.0 → essreduce-26.1.0}/CODE_OF_CONDUCT.md +0 -0
  40. {essreduce-25.12.0 → essreduce-26.1.0}/CONTRIBUTING.md +0 -0
  41. {essreduce-25.12.0 → essreduce-26.1.0}/LICENSE +0 -0
  42. {essreduce-25.12.0 → essreduce-26.1.0}/MANIFEST.in +0 -0
  43. {essreduce-25.12.0 → essreduce-26.1.0}/README.md +0 -0
  44. {essreduce-25.12.0 → essreduce-26.1.0}/docs/_static/anaconda-icon.js +0 -0
  45. {essreduce-25.12.0 → essreduce-26.1.0}/docs/_static/favicon.svg +0 -0
  46. {essreduce-25.12.0 → essreduce-26.1.0}/docs/_static/logo-dark.svg +0 -0
  47. {essreduce-25.12.0 → essreduce-26.1.0}/docs/_static/logo.svg +0 -0
  48. {essreduce-25.12.0 → essreduce-26.1.0}/docs/_templates/class-template.rst +0 -0
  49. {essreduce-25.12.0 → essreduce-26.1.0}/docs/_templates/doc_version.html +0 -0
  50. {essreduce-25.12.0 → essreduce-26.1.0}/docs/_templates/module-template.rst +0 -0
  51. {essreduce-25.12.0 → essreduce-26.1.0}/docs/about/index.md +0 -0
  52. {essreduce-25.12.0 → essreduce-26.1.0}/docs/api-reference/index.md +0 -0
  53. {essreduce-25.12.0 → essreduce-26.1.0}/docs/conf.py +0 -0
  54. {essreduce-25.12.0 → essreduce-26.1.0}/docs/developer/coding-conventions.md +0 -0
  55. {essreduce-25.12.0 → essreduce-26.1.0}/docs/developer/dependency-management.md +0 -0
  56. {essreduce-25.12.0 → essreduce-26.1.0}/docs/developer/getting-started.md +0 -0
  57. {essreduce-25.12.0 → essreduce-26.1.0}/docs/developer/gui.ipynb +0 -0
  58. {essreduce-25.12.0 → essreduce-26.1.0}/docs/developer/index.md +0 -0
  59. {essreduce-25.12.0 → essreduce-26.1.0}/docs/index.md +0 -0
  60. {essreduce-25.12.0 → essreduce-26.1.0}/docs/user-guide/index.md +0 -0
  61. {essreduce-25.12.0 → essreduce-26.1.0}/docs/user-guide/installation.md +0 -0
  62. {essreduce-25.12.0 → essreduce-26.1.0}/docs/user-guide/reduction-workflow-guidelines.md +0 -0
  63. {essreduce-25.12.0 → essreduce-26.1.0}/docs/user-guide/tof/index.md +0 -0
  64. {essreduce-25.12.0 → essreduce-26.1.0}/docs/user-guide/widget.md +0 -0
  65. {essreduce-25.12.0 → essreduce-26.1.0}/pyproject.toml +0 -0
  66. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/base.in +0 -0
  67. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/basetest.in +0 -0
  68. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/ci.in +0 -0
  69. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/ci.txt +0 -0
  70. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/dev.in +0 -0
  71. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/dev.txt +0 -0
  72. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/docs.in +0 -0
  73. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/docs.txt +0 -0
  74. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/make_base.py +0 -0
  75. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/mypy.in +0 -0
  76. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/mypy.txt +0 -0
  77. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/nightly.in +0 -0
  78. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/nightly.txt +0 -0
  79. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/static.in +0 -0
  80. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/static.txt +0 -0
  81. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/test.in +0 -0
  82. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/test.txt +0 -0
  83. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/wheels.in +0 -0
  84. {essreduce-25.12.0 → essreduce-26.1.0}/requirements/wheels.txt +0 -0
  85. {essreduce-25.12.0 → essreduce-26.1.0}/resources/logo.svg +0 -0
  86. {essreduce-25.12.0 → essreduce-26.1.0}/setup.cfg +0 -0
  87. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/__init__.py +0 -0
  88. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/data/__init__.py +0 -0
  89. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/data/_registry.py +0 -0
  90. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/live/__init__.py +0 -0
  91. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/live/raw.py +0 -0
  92. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/live/roi.py +0 -0
  93. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/live/workflow.py +0 -0
  94. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/logging.py +0 -0
  95. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/nexus/__init__.py +0 -0
  96. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/nexus/_nexus_loader.py +0 -0
  97. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/nexus/json_generator.py +0 -0
  98. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/nexus/json_nexus.py +0 -0
  99. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/nexus/types.py +0 -0
  100. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/parameter.py +0 -0
  101. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/py.typed +0 -0
  102. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/scripts/grow_nexus.py +0 -0
  103. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/streaming.py +0 -0
  104. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/time_of_flight/fakes.py +0 -0
  105. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/time_of_flight/interpolator_numba.py +0 -0
  106. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/time_of_flight/interpolator_scipy.py +0 -0
  107. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/time_of_flight/resample.py +0 -0
  108. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/ui.py +0 -0
  109. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/uncertainty.py +0 -0
  110. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/widgets/__init__.py +0 -0
  111. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/widgets/_base.py +0 -0
  112. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/widgets/_binedges_widget.py +0 -0
  113. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/widgets/_bounds_widget.py +0 -0
  114. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/widgets/_config.py +0 -0
  115. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/widgets/_filename_widget.py +0 -0
  116. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/widgets/_linspace_widget.py +0 -0
  117. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/widgets/_optional_widget.py +0 -0
  118. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/widgets/_spinner.py +0 -0
  119. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/widgets/_string_widget.py +0 -0
  120. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/widgets/_switchable_widget.py +0 -0
  121. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/widgets/_vector_widget.py +0 -0
  122. {essreduce-25.12.0 → essreduce-26.1.0}/src/ess/reduce/workflow.py +0 -0
  123. {essreduce-25.12.0 → essreduce-26.1.0}/src/essreduce.egg-info/SOURCES.txt +0 -0
  124. {essreduce-25.12.0 → essreduce-26.1.0}/src/essreduce.egg-info/dependency_links.txt +0 -0
  125. {essreduce-25.12.0 → essreduce-26.1.0}/src/essreduce.egg-info/entry_points.txt +0 -0
  126. {essreduce-25.12.0 → essreduce-26.1.0}/src/essreduce.egg-info/requires.txt +0 -0
  127. {essreduce-25.12.0 → essreduce-26.1.0}/src/essreduce.egg-info/top_level.txt +0 -0
  128. {essreduce-25.12.0 → essreduce-26.1.0}/tests/accumulators_test.py +0 -0
  129. {essreduce-25.12.0 → essreduce-26.1.0}/tests/conftest.py +0 -0
  130. {essreduce-25.12.0 → essreduce-26.1.0}/tests/live/raw_test.py +0 -0
  131. {essreduce-25.12.0 → essreduce-26.1.0}/tests/live/roi_test.py +0 -0
  132. {essreduce-25.12.0 → essreduce-26.1.0}/tests/nexus/json_generator_test.py +0 -0
  133. {essreduce-25.12.0 → essreduce-26.1.0}/tests/nexus/json_nexus_examples/array_dataset.json +0 -0
  134. {essreduce-25.12.0 → essreduce-26.1.0}/tests/nexus/json_nexus_examples/dataset.json +0 -0
  135. {essreduce-25.12.0 → essreduce-26.1.0}/tests/nexus/json_nexus_examples/detector.json +0 -0
  136. {essreduce-25.12.0 → essreduce-26.1.0}/tests/nexus/json_nexus_examples/entry.json +0 -0
  137. {essreduce-25.12.0 → essreduce-26.1.0}/tests/nexus/json_nexus_examples/event_data.json +0 -0
  138. {essreduce-25.12.0 → essreduce-26.1.0}/tests/nexus/json_nexus_examples/instrument.json +0 -0
  139. {essreduce-25.12.0 → essreduce-26.1.0}/tests/nexus/json_nexus_examples/log.json +0 -0
  140. {essreduce-25.12.0 → essreduce-26.1.0}/tests/nexus/json_nexus_test.py +0 -0
  141. {essreduce-25.12.0 → essreduce-26.1.0}/tests/nexus/nexus_loader_test.py +0 -0
  142. {essreduce-25.12.0 → essreduce-26.1.0}/tests/package_test.py +0 -0
  143. {essreduce-25.12.0 → essreduce-26.1.0}/tests/scripts/test_grow_nexus.py +0 -0
  144. {essreduce-25.12.0 → essreduce-26.1.0}/tests/streaming_test.py +0 -0
  145. {essreduce-25.12.0 → essreduce-26.1.0}/tests/time_of_flight/interpolator_test.py +0 -0
  146. {essreduce-25.12.0 → essreduce-26.1.0}/tests/time_of_flight/resample_tests.py +0 -0
  147. {essreduce-25.12.0 → essreduce-26.1.0}/tests/uncertainty_test.py +0 -0
  148. {essreduce-25.12.0 → essreduce-26.1.0}/tests/widget_test.py +0 -0
  149. {essreduce-25.12.0 → essreduce-26.1.0}/tools/shrink_nexus.py +0 -0
@@ -1,6 +1,6 @@
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  Metadata-Version: 2.4
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  Name: essreduce
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- Version: 25.12.0
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+ Version: 26.1.0
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  Summary: Common data reduction tools for the ESS facility
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  Author: Scipp contributors
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  License-Expression: BSD-3-Clause
@@ -311,7 +311,7 @@
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  "id": "21",
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  "metadata": {},
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  "source": [
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- "By default, the workflow tries to load a `TimeOfFlightLookupTable` from a file.\n",
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+ "By default, the workflow tries to load a `TofLookupTable` from a file.\n",
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  "\n",
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  "In this notebook, instead of using such a pre-made file,\n",
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  "we will build our own lookup table from the chopper information and apply it to the workflow."
@@ -346,7 +346,7 @@
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  " sc.scalar(75.5, unit=\"m\"),\n",
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  " sc.scalar(78.0, unit=\"m\"),\n",
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  ")\n",
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- "lut_wf.visualize(TimeOfFlightLookupTable)"
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+ "lut_wf.visualize(TofLookupTable)"
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  ]
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  },
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  {
@@ -411,7 +411,7 @@
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  "metadata": {},
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  "outputs": [],
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  "source": [
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- "table = lut_wf.compute(TimeOfFlightLookupTable)\n",
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+ "table = lut_wf.compute(TofLookupTable)\n",
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  "\n",
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  "# Overlay mean on the figure above\n",
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  "table.array[\"distance\", 13].plot(ax=fig2.ax, color=\"C1\", ls=\"-\", marker=None)"
@@ -453,7 +453,7 @@
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  "outputs": [],
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  "source": [
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  "# Set the computed lookup table onto the original workflow\n",
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- "wf[TimeOfFlightLookupTable] = table\n",
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+ "wf[TofLookupTable] = table\n",
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  "\n",
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  "# Compute time-of-flight of neutron events\n",
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  "tofs = wf.compute(TofDetector[SampleRun])\n",
@@ -743,7 +743,7 @@
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  "metadata": {},
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  "outputs": [],
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  "source": [
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- "table = lut_wf.compute(TimeOfFlightLookupTable).array\n",
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+ "table = lut_wf.compute(TofLookupTable).array\n",
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  "table.plot() / (sc.stddevs(table) / sc.values(table)).plot(norm=\"log\")"
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  ]
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  },
@@ -769,7 +769,7 @@
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  "source": [
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  "lut_wf[LookupTableRelativeErrorThreshold] = 0.01\n",
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  "\n",
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- "table = lut_wf.compute(TimeOfFlightLookupTable)\n",
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+ "table = lut_wf.compute(TofLookupTable)\n",
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  "table.plot()"
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  ]
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  },
@@ -797,7 +797,7 @@
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  "wf[RawDetector[SampleRun]] = ess_beamline.get_monitor(\"detector\")[0]\n",
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  "wf[DetectorLtotal[SampleRun]] = Ltotal\n",
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  "\n",
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- "wf[TimeOfFlightLookupTable] = table\n",
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+ "wf[TofLookupTable] = table\n",
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  "\n",
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  "# Compute time-of-flight\n",
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  "tofs = wf.compute(TofDetector[SampleRun])\n",
@@ -171,7 +171,7 @@
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  "id": "9",
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  "metadata": {},
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  "source": [
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- "By default, the workflow tries to load a `TimeOfFlightLookupTable` from a file.\n",
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+ "By default, the workflow tries to load a `TofLookupTable` from a file.\n",
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  "\n",
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  "In this notebook, instead of using such a pre-made file,\n",
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  "we will build our own lookup table from the chopper information and apply it to the workflow.\n",
@@ -227,7 +227,7 @@
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  "}\n",
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  "lut_wf[SourcePosition] = sc.vector([0, 0, 0], unit=\"m\")\n",
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  "\n",
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- "lut_wf.visualize(TimeOfFlightLookupTable)"
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+ "lut_wf.visualize(TofLookupTable)"
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  ]
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  },
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  {
@@ -245,7 +245,7 @@
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  "metadata": {},
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  "outputs": [],
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  "source": [
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- "table = lut_wf.compute(TimeOfFlightLookupTable)\n",
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+ "table = lut_wf.compute(TofLookupTable)\n",
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  "table.plot()"
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  ]
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  },
@@ -267,7 +267,7 @@
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  "outputs": [],
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  "source": [
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  "# Set the computed lookup table on the original workflow\n",
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- "wf[TimeOfFlightLookupTable] = table\n",
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+ "wf[TofLookupTable] = table\n",
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  "\n",
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  "# Compute neutron tofs\n",
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  "tofs = wf.compute(TofDetector[SampleRun])\n",
@@ -432,7 +432,7 @@
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  "metadata": {},
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  "outputs": [],
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  "source": [
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- "table = lut_wf.compute(TimeOfFlightLookupTable)\n",
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+ "table = lut_wf.compute(TofLookupTable)\n",
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  "\n",
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  "table.plot(figsize=(9, 4))"
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  ]
@@ -457,7 +457,7 @@
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  "nxevent_data = results.to_nxevent_data()\n",
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  "wf[RawDetector[SampleRun]] = nxevent_data\n",
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  "wf[DetectorLtotal[SampleRun]] = nxevent_data.coords[\"Ltotal\"]\n",
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- "wf[TimeOfFlightLookupTable] = table\n",
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+ "wf[TofLookupTable] = table\n",
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  "\n",
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  "tofs = wf.compute(TofDetector[SampleRun])\n",
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  "\n",
@@ -332,7 +332,7 @@
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  "id": "20",
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  "metadata": {},
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  "source": [
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- "By default, the workflow tries to load a `TimeOfFlightLookupTable` from a file.\n",
335
+ "By default, the workflow tries to load a `TofLookupTable` from a file.\n",
336
336
  "\n",
337
337
  "In this notebook, instead of using such a pre-made file,\n",
338
338
  "we will build our own lookup table from the chopper information and apply it to the workflow."
@@ -365,7 +365,7 @@
365
365
  "lut_wf[SourcePosition] = source_position\n",
366
366
  "lut_wf[LtotalRange] = Ltotal, Ltotal\n",
367
367
  "lut_wf[LookupTableRelativeErrorThreshold] = 0.1\n",
368
- "lut_wf.visualize(TimeOfFlightLookupTable)"
368
+ "lut_wf.visualize(TofLookupTable)"
369
369
  ]
370
370
  },
371
371
  {
@@ -430,7 +430,7 @@
430
430
  "metadata": {},
431
431
  "outputs": [],
432
432
  "source": [
433
- "table = lut_wf.compute(TimeOfFlightLookupTable)\n",
433
+ "table = lut_wf.compute(TofLookupTable)\n",
434
434
  "\n",
435
435
  "# Overlay mean on the figure above\n",
436
436
  "table.array[\"distance\", 1].plot(ax=fig2.ax, color=\"C1\", ls=\"-\", marker=None)\n",
@@ -463,7 +463,7 @@
463
463
  "metadata": {},
464
464
  "outputs": [],
465
465
  "source": [
466
- "wf[TimeOfFlightLookupTable] = table\n",
466
+ "wf[TofLookupTable] = table\n",
467
467
  "\n",
468
468
  "tofs = wf.compute(TofDetector[SampleRun])\n",
469
469
  "tofs"
@@ -67,7 +67,7 @@ python-dateutil==2.9.0.post0
67
67
  # scippneutron
68
68
  sciline==25.11.1
69
69
  # via -r base.in
70
- scipp==25.11.0
70
+ scipp==25.12.0
71
71
  # via
72
72
  # -r base.in
73
73
  # scippneutron
@@ -99,7 +99,7 @@ python-dateutil==2.9.0.post0
99
99
  # via matplotlib
100
100
  requests==2.32.5
101
101
  # via pooch
102
- scipp==25.11.0
102
+ scipp==25.12.0
103
103
  # via tof
104
104
  scipy==1.16.3
105
105
  # via -r basetest.in
@@ -370,6 +370,8 @@ def get_calibrated_detector(
370
370
  ----------
371
371
  detector:
372
372
  NeXus detector group.
373
+ transform:
374
+ Transformation matrix for the detector.
373
375
  offset:
374
376
  Offset to add to the detector position.
375
377
  bank_sizes:
@@ -430,8 +432,8 @@ def assemble_detector_data(
430
432
 
431
433
  def get_calibrated_monitor(
432
434
  monitor: NeXusComponent[MonitorType, RunType],
435
+ transform: NeXusTransformation[MonitorType, RunType],
433
436
  offset: MonitorPositionOffset[RunType, MonitorType],
434
- source_position: Position[snx.NXsource, RunType],
435
437
  ) -> EmptyMonitor[RunType, MonitorType]:
436
438
  """
437
439
  Extract the data array corresponding to a monitor's signal field.
@@ -443,16 +445,16 @@ def get_calibrated_monitor(
443
445
  ----------
444
446
  monitor:
445
447
  NeXus monitor group.
448
+ transform:
449
+ Transformation matrix for the monitor.
446
450
  offset:
447
451
  Offset to add to the monitor position.
448
- source_position:
449
- Position of the neutron source.
450
452
  """
451
- monitor = nexus.compute_component_position(monitor)
453
+ transform_unit = transform.value.unit
452
454
  return EmptyMonitor[RunType, MonitorType](
453
455
  nexus.extract_signal_data_array(monitor).assign_coords(
454
- position=monitor['position'] + offset.to(unit=monitor['position'].unit),
455
- source_position=source_position,
456
+ position=transform.value * sc.vector([0, 0, 0], unit=transform_unit)
457
+ + offset.to(unit=transform_unit),
456
458
  )
457
459
  )
458
460
 
@@ -2,7 +2,11 @@
2
2
  # Copyright (c) 2025 Scipp contributors (https://github.com/scipp)
3
3
  """Normalization routines for neutron data reduction."""
4
4
 
5
+ from __future__ import annotations
6
+
7
+ import enum
5
8
  import functools
9
+ import warnings
6
10
 
7
11
  import scipp as sc
8
12
 
@@ -14,6 +18,7 @@ def normalize_by_monitor_histogram(
14
18
  *,
15
19
  monitor: sc.DataArray,
16
20
  uncertainty_broadcast_mode: UncertaintyBroadcastMode,
21
+ skip_range_check: bool = False,
17
22
  ) -> sc.DataArray:
18
23
  """Normalize detector data by a normalized histogrammed monitor.
19
24
 
@@ -23,10 +28,13 @@ def normalize_by_monitor_histogram(
23
28
  - For *event* detectors, the monitor values are mapped to the detector
24
29
  using :func:`scipp.lookup`. That is, for detector event :math:`d_i`,
25
30
  :math:`m_i` is the monitor bin value at the same coordinate.
26
- - For *histogram* detectors, the monitor is rebinned using to the detector
31
+ - For *histogram* detectors, the monitor is generally rebinned using the detector
27
32
  binning using :func:`scipp.rebin`. Thus, detector value :math:`d_i` and
28
33
  monitor value :math:`m_i` correspond to the same bin.
29
34
 
35
+ - In case the detector coordinate does not have a dimension in common with the
36
+ monitor, :func:`scipp.lookup` is used as in the event case.
37
+
30
38
  In both cases, let :math:`x_i` be the lower bound of monitor bin :math:`i`
31
39
  and let :math:`\\Delta x_i = x_{i+1} - x_i` be the width of that bin.
32
40
 
@@ -47,6 +55,16 @@ def normalize_by_monitor_histogram(
47
55
  Must be one-dimensional and have a dimension coordinate, typically "wavelength".
48
56
  uncertainty_broadcast_mode:
49
57
  Choose how uncertainties of the monitor are broadcast to the sample data.
58
+ skip_range_check:
59
+ If false (default), the detector data must be within the range of the monitor
60
+ coordinate. Set this to true to disable the check.
61
+ The value of out-of-range bins / events is undefined in that case.
62
+
63
+ This is useful when the detector contains data outside the monitor range, and it
64
+ is difficult or impossible to slice the detector without also removing in-range
65
+ data. In this case, the caller can mask those data points and skip the range
66
+ check. ``normalize_by_monitor_histogram`` does not take masks into account when
67
+ checking ranges as that is expensive to implement in a general case.
50
68
 
51
69
  Returns
52
70
  -------
@@ -60,22 +78,45 @@ def normalize_by_monitor_histogram(
60
78
  normalize_by_monitor_integrated:
61
79
  Normalize by an integrated monitor.
62
80
  """
63
- _check_monitor_range_contains_detector(monitor=monitor, detector=detector)
81
+ if not skip_range_check:
82
+ _check_monitor_range_contains_detector(monitor=monitor, detector=detector)
64
83
 
65
84
  dim = monitor.dim
66
85
 
67
- if detector.bins is None:
68
- monitor = monitor.rebin({dim: detector.coords[dim]})
69
- detector = _mask_detector_for_norm(detector=detector, monitor=monitor)
70
- coord = monitor.coords[dim]
71
- delta_w = sc.DataArray(coord[1:] - coord[:-1], masks=monitor.masks)
72
- norm = broadcast_uncertainties(
73
- monitor / delta_w, prototype=detector, mode=uncertainty_broadcast_mode
74
- )
75
-
76
- if detector.bins is None:
77
- return detector / norm.rebin({dim: detector.coords[dim]})
78
- return detector.bins / sc.lookup(norm, dim=dim)
86
+ match _HistogramNormalizationMode.deduce(detector, dim):
87
+ case _HistogramNormalizationMode.Events:
88
+ detector = _mask_detector_for_norm(detector=detector, monitor=monitor)
89
+ norm = _histogram_monitor_term(
90
+ monitor,
91
+ dim,
92
+ broadcast_to=detector,
93
+ uncertainty_broadcast_mode=uncertainty_broadcast_mode,
94
+ )
95
+ if dim in detector.bins.coords:
96
+ return detector.bins / sc.lookup(norm, dim=dim)
97
+ else:
98
+ return detector / norm
99
+
100
+ case _HistogramNormalizationMode.BinsCommonDim:
101
+ monitor = monitor.rebin({dim: detector.coords[dim]})
102
+ detector = _mask_detector_for_norm(detector=detector, monitor=monitor)
103
+ norm = _histogram_monitor_term(
104
+ monitor,
105
+ dim,
106
+ broadcast_to=detector,
107
+ uncertainty_broadcast_mode=uncertainty_broadcast_mode,
108
+ )
109
+ return detector / norm
110
+
111
+ case _HistogramNormalizationMode.BinsDifferentDim:
112
+ detector = _mask_detector_for_norm(detector=detector, monitor=monitor)
113
+ # No broadcast here because there are no common dims, use lookup instead.
114
+ norm = _histogram_monitor_term(
115
+ monitor,
116
+ dim,
117
+ uncertainty_broadcast_mode=uncertainty_broadcast_mode,
118
+ )
119
+ return detector / sc.lookup(norm)[_compute_bin_centers(detector, dim)]
79
120
 
80
121
 
81
122
  def normalize_by_monitor_integrated(
@@ -83,6 +124,7 @@ def normalize_by_monitor_integrated(
83
124
  *,
84
125
  monitor: sc.DataArray,
85
126
  uncertainty_broadcast_mode: UncertaintyBroadcastMode,
127
+ skip_range_check: bool = False,
86
128
  ) -> sc.DataArray:
87
129
  """Normalize detector data by an integrated monitor.
88
130
 
@@ -113,6 +155,16 @@ def normalize_by_monitor_integrated(
113
155
  Must be one-dimensional and have a dimension coordinate, typically "wavelength".
114
156
  uncertainty_broadcast_mode:
115
157
  Choose how uncertainties of the monitor are broadcast to the sample data.
158
+ skip_range_check:
159
+ If false (default), the detector data must be within the range of the monitor
160
+ coordinate. Set this to true to disable the check.
161
+ The value of out-of-range bins / events is undefined in that case.
162
+
163
+ This is useful when the detector contains data outside the monitor range, and it
164
+ is difficult or impossible to slice the detector without also removing in-range
165
+ data. In this case, the caller can mask those data points and skip the range
166
+ check. ``normalize_by_monitor_histogram`` does not take masks into account when
167
+ checking ranges as that is expensive to implement in a general case.
116
168
 
117
169
  Returns
118
170
  -------
@@ -126,7 +178,8 @@ def normalize_by_monitor_integrated(
126
178
  normalize_by_monitor_histogram:
127
179
  Normalize by a monitor histogram.
128
180
  """
129
- _check_monitor_range_contains_detector(monitor=monitor, detector=detector)
181
+ if not skip_range_check:
182
+ _check_monitor_range_contains_detector(monitor=monitor, detector=detector)
130
183
  detector = _mask_detector_for_norm(detector=detector, monitor=monitor)
131
184
  norm = monitor.nansum().data
132
185
  norm = broadcast_uncertainties(
@@ -149,15 +202,15 @@ def _check_monitor_range_contains_detector(
149
202
  # monitor range that is less than the detector bins which is fine for the events,
150
203
  # but would be wrong if the detector was subsequently histogrammed.
151
204
  if (det_coord := detector.coords.get(dim)) is not None:
152
- lo = det_coord[dim, :-1].nanmin()
153
- hi = det_coord[dim, 1:].nanmax()
205
+ ...
154
206
  elif (det_coord := detector.bins.coords.get(dim)) is not None:
155
- lo = det_coord.nanmin()
156
- hi = det_coord.nanmax()
207
+ ...
157
208
  else:
158
209
  raise sc.CoordError(
159
210
  f"Missing '{dim}' coordinate in detector for monitor normalization."
160
211
  )
212
+ lo = det_coord.nanmin()
213
+ hi = det_coord.nanmax()
161
214
 
162
215
  if monitor.coords[dim].min() > lo or monitor.coords[dim].max() < hi:
163
216
  raise ValueError(
@@ -181,13 +234,17 @@ def _mask_detector_for_norm(
181
234
  if (monitor_mask := _monitor_mask(monitor)) is None:
182
235
  return detector
183
236
 
184
- if (detector_coord := detector.coords.get(monitor.dim)) is not None:
237
+ if (detector_coord := detector.coords.get(dim)) is not None:
185
238
  # Apply the mask to the bins or a dense detector.
186
- # Use rebin to reshape the mask to the detector.
187
- mask = sc.DataArray(monitor_mask, coords={dim: monitor.coords[dim]}).rebin(
188
- {dim: detector_coord}
189
- ).data != sc.scalar(0, unit=None)
190
- return detector.assign_masks({"_monitor_mask": mask})
239
+ mask_da = sc.DataArray(monitor_mask, coords={dim: monitor.coords[dim]})
240
+ if dim in detector_coord.dims:
241
+ # Use rebin to reshape the mask to the detector.
242
+ mask = mask_da.rebin({dim: detector_coord}).data != sc.scalar(0, unit=None)
243
+ return detector.assign_masks(_monitor_mask=mask)
244
+ # else: need to use lookup to apply mask at matching coord elements
245
+ return detector.assign_masks(
246
+ _monitor_mask=sc.lookup(mask_da)[_compute_bin_centers(detector, dim)]
247
+ )
191
248
 
192
249
  # else: Apply the mask to the events.
193
250
  if dim not in detector.bins.coords:
@@ -197,7 +254,7 @@ def _mask_detector_for_norm(
197
254
  event_mask = sc.lookup(
198
255
  sc.DataArray(monitor_mask, coords={dim: monitor.coords[dim]})
199
256
  )[detector.bins.coords[dim]]
200
- return detector.bins.assign_masks({"_monitor_mask": event_mask})
257
+ return detector.bins.assign_masks(_monitor_mask=event_mask)
201
258
 
202
259
 
203
260
  def _monitor_mask(monitor: sc.DataArray) -> sc.Variable | None:
@@ -213,3 +270,74 @@ def _monitor_mask(monitor: sc.DataArray) -> sc.Variable | None:
213
270
  if not masks:
214
271
  return None
215
272
  return functools.reduce(sc.logical_or, masks)
273
+
274
+
275
+ def _histogram_monitor_term(
276
+ monitor: sc.DataArray,
277
+ dim: str,
278
+ *,
279
+ broadcast_to: sc.DataArray | None = None,
280
+ uncertainty_broadcast_mode: UncertaintyBroadcastMode,
281
+ ) -> sc.DataArray:
282
+ if not monitor.coords.is_edges(dim, dim):
283
+ raise sc.CoordError(
284
+ f"Monitor coordinage {dim} must be bin-edges for normalization."
285
+ )
286
+ coord = monitor.coords[dim]
287
+ delta_w = sc.DataArray(coord[1:] - coord[:-1], masks=monitor.masks)
288
+ norm = monitor / delta_w
289
+
290
+ if broadcast_to is not None:
291
+ return broadcast_uncertainties(
292
+ norm, prototype=broadcast_to, mode=uncertainty_broadcast_mode
293
+ )
294
+
295
+ match uncertainty_broadcast_mode:
296
+ case UncertaintyBroadcastMode.fail:
297
+ return norm
298
+ case UncertaintyBroadcastMode.drop:
299
+ return sc.values(norm)
300
+ case _:
301
+ warnings.warn(
302
+ "Cannot broadcast uncertainties in this case.",
303
+ UserWarning,
304
+ stacklevel=3,
305
+ )
306
+ return norm
307
+
308
+
309
+ class _HistogramNormalizationMode(enum.Enum):
310
+ Events = enum.auto()
311
+ """Use an event coordinate to lookup monitor values."""
312
+ BinsCommonDim = enum.auto()
313
+ """Use a bin coordinate which contains the monitor dimension.
314
+
315
+ The coordinate may be multi-dimensional but one dimension matches
316
+ the dimension of the monitor.
317
+ """
318
+ BinsDifferentDim = enum.auto()
319
+ """Use a bin coordinate which does not contain the monitor dimension.
320
+
321
+ The coordinate may be multi-dimensions, e.g., in the DREAM powder workflow
322
+ where it has dims (two_theta, dspacing [bin-edges]).
323
+ """
324
+
325
+ @classmethod
326
+ def deduce(cls, detector: sc.DataArray, dim: str) -> _HistogramNormalizationMode:
327
+ # Use an event-coord when available:
328
+ if detector.bins is not None and dim in detector.bins.coords:
329
+ return _HistogramNormalizationMode.Events
330
+ # else: use a bin-coord.
331
+
332
+ det_coord = detector.coords[dim]
333
+ if dim in det_coord.dims:
334
+ return _HistogramNormalizationMode.BinsCommonDim
335
+ return _HistogramNormalizationMode.BinsDifferentDim
336
+
337
+
338
+ def _compute_bin_centers(da: sc.DataArray, name: str) -> sc.Variable:
339
+ coord = da.coords[name]
340
+ for dim in coord.dims:
341
+ if da.coords.is_edges(name, dim):
342
+ coord = sc.midpoints(coord, dim=dim)
343
+ return coord
@@ -30,6 +30,8 @@ from .types import (
30
30
  TimeOfFlightLookupTableFilename,
31
31
  ToaDetector,
32
32
  TofDetector,
33
+ TofLookupTable,
34
+ TofLookupTableFilename,
33
35
  TofMonitor,
34
36
  )
35
37
  from .workflow import GenericTofWorkflow
@@ -54,6 +56,8 @@ __all__ = [
54
56
  "TimeResolution",
55
57
  "ToaDetector",
56
58
  "TofDetector",
59
+ "TofLookupTable",
60
+ "TofLookupTableFilename",
57
61
  "TofLookupTableWorkflow",
58
62
  "TofMonitor",
59
63
  "providers",
@@ -35,9 +35,9 @@ from .types import (
35
35
  DetectorLtotal,
36
36
  MonitorLtotal,
37
37
  PulseStrideOffset,
38
- TimeOfFlightLookupTable,
39
38
  ToaDetector,
40
39
  TofDetector,
40
+ TofLookupTable,
41
41
  TofMonitor,
42
42
  )
43
43
 
@@ -96,7 +96,7 @@ class TofInterpolator:
96
96
 
97
97
 
98
98
  def _time_of_flight_data_histogram(
99
- da: sc.DataArray, lookup: TimeOfFlightLookupTable, ltotal: sc.Variable
99
+ da: sc.DataArray, lookup: TofLookupTable, ltotal: sc.Variable
100
100
  ) -> sc.DataArray:
101
101
  # In NeXus, 'time_of_flight' is the canonical name in NXmonitor, but in some files,
102
102
  # it may be called 'tof' or 'frame_time'.
@@ -201,7 +201,7 @@ def _guess_pulse_stride_offset(
201
201
 
202
202
  def _prepare_tof_interpolation_inputs(
203
203
  da: sc.DataArray,
204
- lookup: TimeOfFlightLookupTable,
204
+ lookup: TofLookupTable,
205
205
  ltotal: sc.Variable,
206
206
  pulse_stride_offset: int | None,
207
207
  ) -> dict:
@@ -295,7 +295,7 @@ def _prepare_tof_interpolation_inputs(
295
295
 
296
296
  def _time_of_flight_data_events(
297
297
  da: sc.DataArray,
298
- lookup: TimeOfFlightLookupTable,
298
+ lookup: TofLookupTable,
299
299
  ltotal: sc.Variable,
300
300
  pulse_stride_offset: int | None,
301
301
  ) -> sc.DataArray:
@@ -317,7 +317,19 @@ def _time_of_flight_data_events(
317
317
  parts = da.bins.constituents
318
318
  parts["data"] = tofs
319
319
  result = da.bins.assign_coords(tof=sc.bins(**parts, validate_indices=False))
320
- return result.bins.drop_coords("event_time_offset")
320
+ out = result.bins.drop_coords("event_time_offset")
321
+
322
+ # The result may still have an 'event_time_zero' dimension (in the case of an
323
+ # event monitor where events were not grouped by pixel).
324
+ if "event_time_zero" in out.dims:
325
+ if ("event_time_zero" in out.coords) and (
326
+ "event_time_zero" not in out.bins.coords
327
+ ):
328
+ out.bins.coords["event_time_zero"] = sc.bins_like(
329
+ out, out.coords["event_time_zero"]
330
+ )
331
+ out = out.bins.concat("event_time_zero")
332
+ return out
321
333
 
322
334
 
323
335
  def detector_ltotal_from_straight_line_approximation(
@@ -357,6 +369,7 @@ def detector_ltotal_from_straight_line_approximation(
357
369
 
358
370
  def monitor_ltotal_from_straight_line_approximation(
359
371
  monitor_beamline: EmptyMonitor[RunType, MonitorType],
372
+ source_position: Position[snx.NXsource, RunType],
360
373
  ) -> MonitorLtotal[RunType, MonitorType]:
361
374
  """
362
375
  Compute Ltotal for the monitor.
@@ -369,7 +382,10 @@ def monitor_ltotal_from_straight_line_approximation(
369
382
  Beamline data for the monitor that contains the positions necessary to compute
370
383
  the straight-line approximation to Ltotal (source and monitor positions).
371
384
  """
372
- graph = scn.conversion.graph.beamline.beamline(scatter=False)
385
+ graph = {
386
+ **scn.conversion.graph.beamline.beamline(scatter=False),
387
+ 'source_position': lambda: source_position,
388
+ }
373
389
  return MonitorLtotal[RunType, MonitorType](
374
390
  monitor_beamline.transform_coords(
375
391
  "Ltotal", graph=graph, keep_intermediate=False
@@ -379,7 +395,7 @@ def monitor_ltotal_from_straight_line_approximation(
379
395
 
380
396
  def _compute_tof_data(
381
397
  da: sc.DataArray,
382
- lookup: TimeOfFlightLookupTable,
398
+ lookup: TofLookupTable,
383
399
  ltotal: sc.Variable,
384
400
  pulse_stride_offset: int,
385
401
  ) -> sc.DataArray:
@@ -397,7 +413,7 @@ def _compute_tof_data(
397
413
 
398
414
  def detector_time_of_flight_data(
399
415
  detector_data: RawDetector[RunType],
400
- lookup: TimeOfFlightLookupTable,
416
+ lookup: TofLookupTable,
401
417
  ltotal: DetectorLtotal[RunType],
402
418
  pulse_stride_offset: PulseStrideOffset,
403
419
  ) -> TofDetector[RunType]:
@@ -431,7 +447,7 @@ def detector_time_of_flight_data(
431
447
 
432
448
  def monitor_time_of_flight_data(
433
449
  monitor_data: RawMonitor[RunType, MonitorType],
434
- lookup: TimeOfFlightLookupTable,
450
+ lookup: TofLookupTable,
435
451
  ltotal: MonitorLtotal[RunType, MonitorType],
436
452
  pulse_stride_offset: PulseStrideOffset,
437
453
  ) -> TofMonitor[RunType, MonitorType]:
@@ -465,7 +481,7 @@ def monitor_time_of_flight_data(
465
481
 
466
482
  def detector_time_of_arrival_data(
467
483
  detector_data: RawDetector[RunType],
468
- lookup: TimeOfFlightLookupTable,
484
+ lookup: TofLookupTable,
469
485
  ltotal: DetectorLtotal[RunType],
470
486
  pulse_stride_offset: PulseStrideOffset,
471
487
  ) -> ToaDetector[RunType]:
@@ -13,7 +13,7 @@ import sciline as sl
13
13
  import scipp as sc
14
14
 
15
15
  from ..nexus.types import AnyRun, DiskChoppers
16
- from .types import TimeOfFlightLookupTable
16
+ from .types import TofLookupTable
17
17
 
18
18
 
19
19
  @dataclass
@@ -230,7 +230,7 @@ def make_tof_lookup_table(
230
230
  pulse_period: PulsePeriod,
231
231
  pulse_stride: PulseStride,
232
232
  error_threshold: LookupTableRelativeErrorThreshold,
233
- ) -> TimeOfFlightLookupTable:
233
+ ) -> TofLookupTable:
234
234
  """
235
235
  Compute a lookup table for time-of-flight as a function of distance and
236
236
  time-of-arrival.
@@ -372,7 +372,7 @@ def make_tof_lookup_table(
372
372
  # In-place masking for better performance
373
373
  _mask_large_uncertainty(table, error_threshold)
374
374
 
375
- return TimeOfFlightLookupTable(
375
+ return TofLookupTable(
376
376
  array=table,
377
377
  pulse_period=pulse_period,
378
378
  pulse_stride=pulse_stride,
@@ -398,13 +398,13 @@ def simulate_chopper_cascade_using_tof(
398
398
  ) -> SimulationResults:
399
399
  """
400
400
  Simulate a pulse of neutrons propagating through a chopper cascade using the
401
- ``tof`` package (https://tof.readthedocs.io).
401
+ ``tof`` package (https://scipp.github.io/tof).
402
402
 
403
403
  Parameters
404
404
  ----------
405
405
  choppers:
406
406
  A dict of DiskChopper objects representing the choppers in the beamline. See
407
- https://scipp.github.io/scippneutron/user-guide/chopper/processing-nexus-choppers.html#Build-DiskChopper
407
+ https://scipp.github.io/scippneutron/user-guide/chopper/processing-nexus-choppers.html
408
408
  for more information.
409
409
  source_position:
410
410
  A scalar variable with ``dtype=vector3`` that defines the source position.