spinlab 0.0.3__tar.gz → 0.0.4__tar.gz

This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
Files changed (78) hide show
  1. {spinlab-0.0.3/SpinLab.egg-info → spinlab-0.0.4}/PKG-INFO +1 -1
  2. {spinlab-0.0.3 → spinlab-0.0.4/SpinLab.egg-info}/PKG-INFO +1 -1
  3. {spinlab-0.0.3 → spinlab-0.0.4}/pyproject.toml +4 -1
  4. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/specman.py +12 -0
  5. spinlab-0.0.4/spinlab/version.py +1 -0
  6. spinlab-0.0.3/spinlab/version.py +0 -1
  7. {spinlab-0.0.3 → spinlab-0.0.4}/LICENSE.txt +0 -0
  8. {spinlab-0.0.3 → spinlab-0.0.4}/MANIFEST.in +0 -0
  9. {spinlab-0.0.3 → spinlab-0.0.4}/README.md +0 -0
  10. {spinlab-0.0.3 → spinlab-0.0.4}/SpinLab.egg-info/SOURCES.txt +0 -0
  11. {spinlab-0.0.3 → spinlab-0.0.4}/SpinLab.egg-info/dependency_links.txt +0 -0
  12. {spinlab-0.0.3 → spinlab-0.0.4}/SpinLab.egg-info/top_level.txt +0 -0
  13. {spinlab-0.0.3 → spinlab-0.0.4}/setup.cfg +0 -0
  14. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/__init__.py +0 -0
  15. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/analysis/__init__.py +0 -0
  16. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/analysis/hydration.py +0 -0
  17. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/analysis/peaks.py +0 -0
  18. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/analysis/relaxation_fit.py +0 -0
  19. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/analysis/simulate_enhancement_profiles.py +0 -0
  20. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/config/__init__.py +0 -0
  21. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/config/config.py +0 -0
  22. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/config/spinlab.cfg +0 -0
  23. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/constants/__init__.py +0 -0
  24. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/constants/constants.py +0 -0
  25. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/constants/mrProperties.py +0 -0
  26. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/constants/radicalProperties.py +0 -0
  27. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/core/__init__.py +0 -0
  28. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/core/base.py +0 -0
  29. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/core/coord.py +0 -0
  30. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/core/data.py +0 -0
  31. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/core/ufunc.py +0 -0
  32. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/core/util.py +0 -0
  33. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/fitting/__init__.py +0 -0
  34. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/fitting/general.py +0 -0
  35. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/__init__.py +0 -0
  36. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/bes3t.py +0 -0
  37. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/cnsi.py +0 -0
  38. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/delta.py +0 -0
  39. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/h5.py +0 -0
  40. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/load.py +0 -0
  41. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/load_csv.py +0 -0
  42. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/logs.py +0 -0
  43. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/mat.py +0 -0
  44. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/power.py +0 -0
  45. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/prospa.py +0 -0
  46. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/random.py +0 -0
  47. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/rs2d.py +0 -0
  48. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/save.py +0 -0
  49. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/tnmr.py +0 -0
  50. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/topspin.py +0 -0
  51. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/vna.py +0 -0
  52. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/vnmrj.py +0 -0
  53. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/winepr.py +0 -0
  54. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/math/__init__.py +0 -0
  55. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/math/lineshape.py +0 -0
  56. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/math/pulses.py +0 -0
  57. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/math/relaxation.py +0 -0
  58. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/math/window.py +0 -0
  59. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/plotting/__init__.py +0 -0
  60. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/plotting/colors.py +0 -0
  61. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/plotting/general.py +0 -0
  62. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/plotting/image.py +0 -0
  63. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/plotting/stack_plot.py +0 -0
  64. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/processing/__init__.py +0 -0
  65. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/processing/align.py +0 -0
  66. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/processing/apodization.py +0 -0
  67. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/processing/average.py +0 -0
  68. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/processing/conversion.py +0 -0
  69. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/processing/fft.py +0 -0
  70. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/processing/helpers.py +0 -0
  71. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/processing/integration.py +0 -0
  72. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/processing/interpolation.py +0 -0
  73. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/processing/offset.py +0 -0
  74. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/processing/phase.py +0 -0
  75. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/reporting/__init__.py +0 -0
  76. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/widgets/__init__.py +0 -0
  77. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/widgets/align_widget.py +0 -0
  78. {spinlab-0.0.3 → spinlab-0.0.4}/spinlab/widgets/phase_widget.py +0 -0
{spinlab-0.0.3/SpinLab.egg-info → spinlab-0.0.4}/PKG-INFO RENAMED
@@ -1,6 +1,6 @@
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  Metadata-Version: 2.4
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  Name: spinlab
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- Version: 0.0.3
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+ Version: 0.0.4
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  Summary: SpinLab - Bringing the Power of Python to NMR-EPR Spectroscopy
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  License-Expression: MIT
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  Keywords: ODNP,DNP,Spin,NMR,EPR
{spinlab-0.0.3 → spinlab-0.0.4/SpinLab.egg-info}/PKG-INFO RENAMED
@@ -1,6 +1,6 @@
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  Metadata-Version: 2.4
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  Name: spinlab
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- Version: 0.0.3
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+ Version: 0.0.4
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  Summary: SpinLab - Bringing the Power of Python to NMR-EPR Spectroscopy
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  License-Expression: MIT
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  Keywords: ODNP,DNP,Spin,NMR,EPR
{spinlab-0.0.3 → spinlab-0.0.4}/pyproject.toml RENAMED
@@ -1,6 +1,6 @@
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  [project]
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  name = "spinlab"
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- version = "0.0.3"
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+ dynamic = ["version"]
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  description = "SpinLab - Bringing the Power of Python to NMR-EPR Spectroscopy"
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  readme = "README.md"
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  requires-python = ">=3.10"
@@ -26,3 +26,6 @@ include-package-data = true
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  [tool.setuptools.package-data]
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  mypkg = ["*.cfg"]
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+
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+ [tool.setuptools.dynamic]
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+ version = {attr = "spinlab.version.__version__"}
{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/specman.py RENAMED
@@ -270,6 +270,12 @@ def analyze_attrs(attrs):
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  stop = float(val_list[stop_index]) * _convert_unit(stop_unit)
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  temp[new_key + "_stop"] = stop
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+ if "logto" in val_list:
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+ logto_index = val_list.index("logto") + 1
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+ logto_unit = val_list[logto_index + 1] if len(val_list) == 5 else None
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+ logto = float(val_list[logto_index]) * _convert_unit(logto_unit)
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+ temp[new_key + "_logto"] = logto
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+
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  if "sweep_" in key:
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  val_list = val.split(",")
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  val = val_list[1] # get value
@@ -344,6 +350,12 @@ def calculate_specman_coords(attrs, old_coords, dims=None):
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  start = attrs[dim]
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  stop = attrs[dim + "_stop"]
346
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  coord = _np.linspace(start, stop, length)
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+ elif dim in attrs and dim + "_logto" in attrs:
354
+ start = attrs[dim]
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+ logto = attrs[dim + "_logto"]
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+ coord = _np.logspace(
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+ _np.log10(start), _np.log10(logto), length, endpoint=True
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+ )
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  elif dim in attrs and dim + "_step" not in attrs and dim + "_stop" not in attrs:
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  val_string = attrs["params_" + dim].split(";")[0]
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  val_string = val_string.replace(", ", ",").split(",")
spinlab-0.0.4/spinlab/version.py ADDED
@@ -0,0 +1 @@
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+ __version__ = "0.0.4"
spinlab-0.0.3/spinlab/version.py DELETED
@@ -1 +0,0 @@
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- __version__ = "0.0.0"
{spinlab-0.0.3 → spinlab-0.0.4}/LICENSE.txt RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/MANIFEST.in RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/README.md RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/setup.cfg RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/__init__.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/core/base.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/core/coord.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/core/data.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/core/ufunc.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/core/util.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/__init__.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/bes3t.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/cnsi.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/delta.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/h5.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/load.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/load_csv.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/logs.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/mat.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/power.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/prospa.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/random.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/rs2d.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/save.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/tnmr.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/topspin.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/vna.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/vnmrj.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/io/winepr.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/math/pulses.py RENAMED
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{spinlab-0.0.3 → spinlab-0.0.4}/spinlab/math/window.py RENAMED
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