EntDetect 1.2.1__tar.gz → 1.2.2__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 (52) hide show
  1. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect.egg-info/PKG-INFO +2 -2
  2. {entdetect-1.2.1 → entdetect-1.2.2}/PKG-INFO +2 -2
  3. {entdetect-1.2.1 → entdetect-1.2.2}/setup.py +2 -2
  4. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/Jwalk/GridTools.py +0 -0
  5. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/Jwalk/PDBTools.py +0 -0
  6. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/Jwalk/SASDTools.py +0 -0
  7. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/Jwalk/SurfaceTools.py +0 -0
  8. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/Jwalk/__init__.py +0 -0
  9. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/Jwalk/naccess.config.txt +0 -0
  10. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/__init__.py +0 -0
  11. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/_logging.py +0 -0
  12. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/change_resolution.py +0 -0
  13. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/clustering.py +0 -0
  14. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/compare_sim2exp.py +0 -0
  15. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/entanglement_features.py +0 -0
  16. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/gaussian_entanglement.py +0 -0
  17. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/order_params.py +0 -0
  18. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/resources/__init__.py +0 -0
  19. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/resources/__pycache__/__init__.cpython-311.pyc +0 -0
  20. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/resources/calc_K.pl +0 -0
  21. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/resources/calc_Q.pl +0 -0
  22. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/resources/pulchra +0 -0
  23. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/resources/shared_files/__init__.py +0 -0
  24. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/resources/shared_files/bt_contact_potential.dat +0 -0
  25. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/resources/shared_files/karanicolas_dihe_parm.dat +0 -0
  26. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/resources/shared_files/kgs_contact_potential.dat +0 -0
  27. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/resources/shared_files/mj_contact_potential.dat +0 -0
  28. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/resources/stride +0 -0
  29. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/statistics.py +0 -0
  30. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect/utilities.py +0 -0
  31. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect.egg-info/SOURCES.txt +0 -0
  32. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect.egg-info/dependency_links.txt +0 -0
  33. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect.egg-info/entry_points.txt +0 -0
  34. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect.egg-info/requires.txt +0 -0
  35. {entdetect-1.2.1 → entdetect-1.2.2}/EntDetect.egg-info/top_level.txt +0 -0
  36. {entdetect-1.2.1 → entdetect-1.2.2}/LICENSE +0 -0
  37. {entdetect-1.2.1 → entdetect-1.2.2}/MANIFEST.in +0 -0
  38. {entdetect-1.2.1 → entdetect-1.2.2}/README.md +0 -0
  39. {entdetect-1.2.1 → entdetect-1.2.2}/pyproject.toml +0 -0
  40. {entdetect-1.2.1 → entdetect-1.2.2}/scripts/__init__.py +0 -0
  41. {entdetect-1.2.1 → entdetect-1.2.2}/scripts/convert_cor_psf_to_pdb.py +0 -0
  42. {entdetect-1.2.1 → entdetect-1.2.2}/scripts/run_Foldingpathway.py +0 -0
  43. {entdetect-1.2.1 → entdetect-1.2.2}/scripts/run_MSM.py +0 -0
  44. {entdetect-1.2.1 → entdetect-1.2.2}/scripts/run_OP_on_simulation_traj.py +0 -0
  45. {entdetect-1.2.1 → entdetect-1.2.2}/scripts/run_change_resolution.py +0 -0
  46. {entdetect-1.2.1 → entdetect-1.2.2}/scripts/run_compare_sim2exp.py +0 -0
  47. {entdetect-1.2.1 → entdetect-1.2.2}/scripts/run_montecarlo.py +0 -0
  48. {entdetect-1.2.1 → entdetect-1.2.2}/scripts/run_nativeNCLE.py +0 -0
  49. {entdetect-1.2.1 → entdetect-1.2.2}/scripts/run_nonnative_entanglement_clustering.py +0 -0
  50. {entdetect-1.2.1 → entdetect-1.2.2}/scripts/run_population_modeling.py +0 -0
  51. {entdetect-1.2.1 → entdetect-1.2.2}/scripts/run_workflow4_nativeNCLE_batch.py +0 -0
  52. {entdetect-1.2.1 → entdetect-1.2.2}/setup.cfg +0 -0
{entdetect-1.2.1 → entdetect-1.2.2}/EntDetect.egg-info/PKG-INFO RENAMED
@@ -1,7 +1,7 @@
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  Metadata-Version: 2.4
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  Name: EntDetect
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- Version: 1.2.1
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- Summary: Entanglement Detection in Protein Structures
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+ Version: 1.2.2
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+ Summary: Non-covalent Lasso-like Entanglement (NCLE) Detection in Protein Structures and trajectories
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  Home-page: https://github.com/obrien-lab-psu/EntDetect
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  Project-URL: Source, https://github.com/obrien-lab-psu/EntDetect
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  Project-URL: Bug Tracker, https://github.com/obrien-lab-psu/EntDetect/issues
{entdetect-1.2.1 → entdetect-1.2.2}/PKG-INFO RENAMED
@@ -1,7 +1,7 @@
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  Metadata-Version: 2.4
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  Name: EntDetect
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- Version: 1.2.1
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- Summary: Entanglement Detection in Protein Structures
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+ Version: 1.2.2
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+ Summary: Non-covalent Lasso-like Entanglement (NCLE) Detection in Protein Structures and trajectories
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  Home-page: https://github.com/obrien-lab-psu/EntDetect
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  Project-URL: Source, https://github.com/obrien-lab-psu/EntDetect
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  Project-URL: Bug Tracker, https://github.com/obrien-lab-psu/EntDetect/issues
{entdetect-1.2.1 → entdetect-1.2.2}/setup.py RENAMED
@@ -5,8 +5,8 @@ with open('README.md', 'r', encoding='utf-8') as f:
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  setup(
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  name='EntDetect',
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- version='1.2.1',
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- description='Entanglement Detection in Protein Structures',
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+ version='1.2.2',
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+ description='Non-covalent Lasso-like Entanglement (NCLE) Detection in Protein Structures and trajectories',
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  long_description=long_description,
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  long_description_content_type='text/markdown',
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  url='https://github.com/obrien-lab-psu/EntDetect',
{entdetect-1.2.1 → entdetect-1.2.2}/LICENSE RENAMED
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{entdetect-1.2.1 → entdetect-1.2.2}/MANIFEST.in RENAMED
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{entdetect-1.2.1 → entdetect-1.2.2}/README.md RENAMED
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{entdetect-1.2.1 → entdetect-1.2.2}/pyproject.toml RENAMED
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{entdetect-1.2.1 → entdetect-1.2.2}/scripts/__init__.py RENAMED
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{entdetect-1.2.1 → entdetect-1.2.2}/scripts/run_MSM.py RENAMED
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{entdetect-1.2.1 → entdetect-1.2.2}/setup.cfg RENAMED
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