MoleditPy-linux 1.16.1a2__py3-none-any.whl → 1.16.1a3__py3-none-any.whl

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 (56) hide show
  1. moleditpy_linux/modules/assets/icon.icns +0 -0
  2. moleditpy_linux/modules/assets/icon.ico +0 -0
  3. moleditpy_linux/modules/assets/icon.png +0 -0
  4. {moleditpy-linux → moleditpy_linux}/modules/constants.py +1 -1
  5. {moleditpy-linux → moleditpy_linux}/modules/main_window_main_init.py +13 -11
  6. {moleditpy_linux-1.16.1a2.dist-info → moleditpy_linux-1.16.1a3.dist-info}/METADATA +1 -1
  7. moleditpy_linux-1.16.1a3.dist-info/RECORD +54 -0
  8. moleditpy_linux-1.16.1a3.dist-info/top_level.txt +1 -0
  9. moleditpy_linux-1.16.1a2.dist-info/RECORD +0 -51
  10. moleditpy_linux-1.16.1a2.dist-info/top_level.txt +0 -1
  11. {moleditpy-linux → moleditpy_linux}/__init__.py +0 -0
  12. {moleditpy-linux → moleditpy_linux}/__main__.py +0 -0
  13. {moleditpy-linux → moleditpy_linux}/main.py +0 -0
  14. {moleditpy-linux → moleditpy_linux}/modules/__init__.py +0 -0
  15. {moleditpy-linux → moleditpy_linux}/modules/about_dialog.py +0 -0
  16. {moleditpy-linux → moleditpy_linux}/modules/align_plane_dialog.py +0 -0
  17. {moleditpy-linux → moleditpy_linux}/modules/alignment_dialog.py +0 -0
  18. {moleditpy-linux → moleditpy_linux}/modules/analysis_window.py +0 -0
  19. {moleditpy-linux → moleditpy_linux}/modules/angle_dialog.py +0 -0
  20. {moleditpy-linux → moleditpy_linux}/modules/atom_item.py +0 -0
  21. {moleditpy-linux → moleditpy_linux}/modules/bond_item.py +0 -0
  22. {moleditpy-linux → moleditpy_linux}/modules/bond_length_dialog.py +0 -0
  23. {moleditpy-linux → moleditpy_linux}/modules/calculation_worker.py +0 -0
  24. {moleditpy-linux → moleditpy_linux}/modules/color_settings_dialog.py +0 -0
  25. {moleditpy-linux → moleditpy_linux}/modules/constrained_optimization_dialog.py +0 -0
  26. {moleditpy-linux → moleditpy_linux}/modules/custom_interactor_style.py +0 -0
  27. {moleditpy-linux → moleditpy_linux}/modules/custom_qt_interactor.py +0 -0
  28. {moleditpy-linux → moleditpy_linux}/modules/dialog3_d_picking_mixin.py +0 -0
  29. {moleditpy-linux → moleditpy_linux}/modules/dihedral_dialog.py +0 -0
  30. {moleditpy-linux → moleditpy_linux}/modules/main_window.py +0 -0
  31. {moleditpy-linux → moleditpy_linux}/modules/main_window_app_state.py +0 -0
  32. {moleditpy-linux → moleditpy_linux}/modules/main_window_compute.py +0 -0
  33. {moleditpy-linux → moleditpy_linux}/modules/main_window_dialog_manager.py +0 -0
  34. {moleditpy-linux → moleditpy_linux}/modules/main_window_edit_3d.py +0 -0
  35. {moleditpy-linux → moleditpy_linux}/modules/main_window_edit_actions.py +0 -0
  36. {moleditpy-linux → moleditpy_linux}/modules/main_window_export.py +0 -0
  37. {moleditpy-linux → moleditpy_linux}/modules/main_window_molecular_parsers.py +0 -0
  38. {moleditpy-linux → moleditpy_linux}/modules/main_window_project_io.py +0 -0
  39. {moleditpy-linux → moleditpy_linux}/modules/main_window_string_importers.py +0 -0
  40. {moleditpy-linux → moleditpy_linux}/modules/main_window_ui_manager.py +0 -0
  41. {moleditpy-linux → moleditpy_linux}/modules/main_window_view_3d.py +0 -0
  42. {moleditpy-linux → moleditpy_linux}/modules/main_window_view_loaders.py +0 -0
  43. {moleditpy-linux → moleditpy_linux}/modules/mirror_dialog.py +0 -0
  44. {moleditpy-linux → moleditpy_linux}/modules/molecular_data.py +0 -0
  45. {moleditpy-linux → moleditpy_linux}/modules/molecule_scene.py +0 -0
  46. {moleditpy-linux → moleditpy_linux}/modules/move_group_dialog.py +0 -0
  47. {moleditpy-linux → moleditpy_linux}/modules/periodic_table_dialog.py +0 -0
  48. {moleditpy-linux → moleditpy_linux}/modules/planarize_dialog.py +0 -0
  49. {moleditpy-linux → moleditpy_linux}/modules/settings_dialog.py +0 -0
  50. {moleditpy-linux → moleditpy_linux}/modules/template_preview_item.py +0 -0
  51. {moleditpy-linux → moleditpy_linux}/modules/template_preview_view.py +0 -0
  52. {moleditpy-linux → moleditpy_linux}/modules/translation_dialog.py +0 -0
  53. {moleditpy-linux → moleditpy_linux}/modules/user_template_dialog.py +0 -0
  54. {moleditpy-linux → moleditpy_linux}/modules/zoomable_view.py +0 -0
  55. {moleditpy_linux-1.16.1a2.dist-info → moleditpy_linux-1.16.1a3.dist-info}/WHEEL +0 -0
  56. {moleditpy_linux-1.16.1a2.dist-info → moleditpy_linux-1.16.1a3.dist-info}/entry_points.txt +0 -0
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@@ -4,7 +4,7 @@ from PyQt6.QtGui import QFont, QColor
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  from rdkit import Chem
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  #Version
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- VERSION = '1.16.1a2'
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+ VERSION = '1.16.1a3'
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  ATOM_RADIUS = 18
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  BOND_OFFSET = 3.5
@@ -79,6 +79,8 @@ def detect_system_theme():
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  # macOS: 'defaults read -g AppleInterfaceStyle'
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  if platform.system() == 'Darwin':
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+ return 'light'
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+ '''
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  try:
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  # 'defaults read ...' が成功すればダークモード
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  p = subprocess.run(
@@ -94,6 +96,7 @@ def detect_system_theme():
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  except Exception:
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  # その他のエラー
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  pass
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+ '''
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  # Linux / GNOME: try color-scheme gsetting; fallback to gtk-theme detection
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  if platform.system() == 'Linux':
@@ -494,11 +497,10 @@ class MainWindowMainInit(object):
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  def _icon_foreground_color():
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  """Return a QColor for icon foreground.
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- NOTE: this application inverts the usual foreground mapping so icons
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- will be the *opposite* color to the background (i.e., black on dark
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- backgrounds, white on light backgrounds). This intentionally reverses
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- the previous behavior so button icons don't blend into the 3D-view
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- background. Priority: explicit setting in 'icon_foreground' -> OS
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+ NOTE: choose icon foreground to contrast against the background
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+ (i.e., white on dark backgrounds, black on light backgrounds). This
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+ matches common conventions. Priority: explicit setting in
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+ 'icon_foreground' -> OS theme preference -> configured 3D
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  theme preference -> configured 3D background -> application palette.
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  """
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  try:
@@ -513,9 +515,9 @@ class MainWindowMainInit(object):
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  # 1) Prefer the system/OS dark-mode preference if available.
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  try:
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  os_pref = detect_system_dark_mode()
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- # Invert the color so in dark-pref OS we return black, in light we return white
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+ # Standard mapping: dark -> white, light -> black
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  if os_pref is not None:
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- return QColor('#000000') if os_pref else QColor('#FFFFFF')
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+ return QColor('#FFFFFF') if os_pref else QColor('#000000')
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  except Exception:
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  pass
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@@ -527,8 +529,8 @@ class MainWindowMainInit(object):
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  bg = QColor(bg_hex)
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  if bg.isValid():
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531
  lum = 0.2126 * bg.redF() + 0.7152 * bg.greenF() + 0.0722 * bg.blueF()
530
- # Inverted: return black on dark (lum<0.5), white on light
531
- return QColor('#000000') if lum < 0.5 else QColor('#FFFFFF')
532
+ # Return white on dark (lum<0.5), black on light
533
+ return QColor('#FFFFFF') if lum < 0.5 else QColor('#000000')
532
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  except Exception:
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  pass
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@@ -537,8 +539,8 @@ class MainWindowMainInit(object):
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  # palette.window() returns a QBrush; call color()
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  window_bg = pal.window().color()
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541
  lum = 0.2126 * window_bg.redF() + 0.7152 * window_bg.greenF() + 0.0722 * window_bg.blueF()
540
- # Inverted mapping for palette fallback
541
- return QColor('#000000') if lum < 0.5 else QColor('#FFFFFF')
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+ # Palette-based mapping: white on dark palette background
543
+ return QColor('#FFFFFF') if lum < 0.5 else QColor('#000000')
542
544
  except Exception:
543
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  return QColor('#000000')
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546
 
@@ -1,6 +1,6 @@
1
1
  Metadata-Version: 2.4
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2
  Name: MoleditPy-linux
3
- Version: 1.16.1a2
3
+ Version: 1.16.1a3
4
4
  Summary: A cross-platform, simple, and intuitive molecular structure editor built in Python. It allows 2D molecular drawing and 3D structure visualization. It supports exporting structure files for input to DFT calculation software.
5
5
  Author-email: HiroYokoyama <titech.yoko.hiro@gmail.com>
6
6
  Project-URL: Homepage, https://github.com/HiroYokoyama/python_molecular_editor
@@ -0,0 +1,54 @@
1
+ moleditpy_linux/__init__.py,sha256=QCzpw3P5V_CwDtN4itK4hT9J99JgsH4gmpTfvuus6p8,46
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+ moleditpy_linux/__main__.py,sha256=az0UrbFsuprbQYycF_bSUXxb0F20DuLvYxrZl1-X5EU,831
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+ moleditpy_linux/main.py,sha256=cEZJuCL0HrLPUYvuwPSxgUkaDykVb573A-3qVvjF9RM,1180
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+ moleditpy_linux/modules/__init__.py,sha256=DIO4nzCCnpeYLjFqzHxcRYqbECtWWMEGQ_-sb03jirs,1127
5
+ moleditpy_linux/modules/about_dialog.py,sha256=_M-8MLGXCDtVd7NW8xtglASOiIWTF7HzO8J8AzMubs0,3419
6
+ moleditpy_linux/modules/align_plane_dialog.py,sha256=D6E0_rM75rKirDkvkJ-diRqNkf8IguqBBLQqDvZJHME,11665
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+ moleditpy_linux/modules/alignment_dialog.py,sha256=tS2_5-wnJRDhLcWtPm9-HUm4_v4bAr53EjV82vydA-k,11140
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+ moleditpy_linux/modules/analysis_window.py,sha256=asSCm7bgDW00tGaXSwEN17j-de_BN7ql6iwmxb3f54E,9134
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+ moleditpy_linux/modules/angle_dialog.py,sha256=_xwp8CyBEB309UEY618o065Hfqx-XZQHYFXa0fYeNNs,17548
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+ moleditpy_linux/modules/atom_item.py,sha256=NSRO4x_5Ciq1Hnt2lfdjtVGGjuZ6iUt2bZ8NGT9FqIg,15297
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+ moleditpy_linux/modules/bond_item.py,sha256=zjQHa4vb8xhS9B7cYPRM0nak-f7lr5NQ1uAj_J78ah4,12778
12
+ moleditpy_linux/modules/bond_length_dialog.py,sha256=xlx-bU3tVeLfShdVRw6_Geo5Gl9mztlIfTdT9tJ6WMA,14579
13
+ moleditpy_linux/modules/calculation_worker.py,sha256=detE48BW08a2tvmKjMgz8zCShgARzsRH-ABmWrPcqZA,42055
14
+ moleditpy_linux/modules/color_settings_dialog.py,sha256=h4AOKU8dCTenecI8zOM9GfnmKDm7jfe5C4Fa23Budvs,15205
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+ moleditpy_linux/modules/constants.py,sha256=WjilRvqiXFWNenqWLdGAfr7iTPEvSp_nojw97fcgrso,4436
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+ moleditpy_linux/modules/constrained_optimization_dialog.py,sha256=MlWnPze0JJvnqmHx9n3qZWG_h-2kZymT0PQ6lALbCro,29861
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+ moleditpy_linux/modules/custom_interactor_style.py,sha256=K_uGM6FezY0kZ3zPqoR6f0nowG40ytt-L4UCAbPlwGM,38184
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+ moleditpy_linux/modules/custom_qt_interactor.py,sha256=6mzaVb3Mhp-4nryG5AraEvPPgBJpotrzVYwrpCAKmVo,2186
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+ moleditpy_linux/modules/dialog3_d_picking_mixin.py,sha256=gaF1ATevvvF72aBfAjubRcagT2jnVG5RMpEKos_XdKg,4768
20
+ moleditpy_linux/modules/dihedral_dialog.py,sha256=H6WFvc7NvPHSd5QCMk0NUPhudOzpModXv-42dYL20KM,17809
21
+ moleditpy_linux/modules/main_window.py,sha256=Ii36JTPSkZNaqqEc8CXZ1bq9accIMg5yUs1U7_pHgYM,35791
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+ moleditpy_linux/modules/main_window_app_state.py,sha256=f9f3JVuC46ijlea2DR8ADa0Jn5r2dgedPPdg8OkmNAU,33374
23
+ moleditpy_linux/modules/main_window_compute.py,sha256=fiIokVvjzXIwwR3FV3Ltet_K4oL_rT0Z27rPMbvlyyc,51346
24
+ moleditpy_linux/modules/main_window_dialog_manager.py,sha256=5WU6mFABB0aI4XCywP-cLFPkNQSb3bC0OK0I28SQG_w,19845
25
+ moleditpy_linux/modules/main_window_edit_3d.py,sha256=FStBWVeDVAM2MoO-JCTjPM-G7iT8QZUHxsb0dS4MEAI,19553
26
+ moleditpy_linux/modules/main_window_edit_actions.py,sha256=8tR0rYfgWYgdKTxBP4snzpxhiD2DExSKyf4jzSWb6sE,64598
27
+ moleditpy_linux/modules/main_window_export.py,sha256=f_Z4qVYKBTe06lGTFqjd3deluUdkQvHhZYa81h7UpBM,34465
28
+ moleditpy_linux/modules/main_window_main_init.py,sha256=xAstCr__601hkbb1IpqpQKUFTSS6quYe66sBOgqJjkc,75228
29
+ moleditpy_linux/modules/main_window_molecular_parsers.py,sha256=8JAIgr1axzmJqX_Ue-Adkl8e_8B2Th9yutQbau8EEWQ,43401
30
+ moleditpy_linux/modules/main_window_project_io.py,sha256=2ArkW23L4ahQIiktCCXlNsJphU0awO5YzJGihIJsn1c,17021
31
+ moleditpy_linux/modules/main_window_string_importers.py,sha256=yrZblvPG840qnqVEJf__XVfNnWl_r3vt68Abfs2aYDQ,10674
32
+ moleditpy_linux/modules/main_window_ui_manager.py,sha256=0jdTZGv5JRtDlDniblPKzLPXdfUBZ3qh12s6pav4ihI,22038
33
+ moleditpy_linux/modules/main_window_view_3d.py,sha256=aU6fI-ZYUV7qOQmucsF5WuafGYyvb4P2xj0oIgsnDaU,55443
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+ moleditpy_linux/modules/main_window_view_loaders.py,sha256=WuzLCYC22eaDFIvUvRtXgULZb-n4B04gcdgSKqTgWGA,14234
35
+ moleditpy_linux/modules/mirror_dialog.py,sha256=wYlnqrxAZfsADB5Gvabe-MoX3j0_NjfmWPyf3GCYj9U,4427
36
+ moleditpy_linux/modules/molecular_data.py,sha256=OCdiRIDXgnqYCKmf56x6XfbOJYTEQjY-MtBfnYZtTWY,12981
37
+ moleditpy_linux/modules/molecule_scene.py,sha256=F7W7HLctfqbtM0gI76fcyEar6Q5t_rWoy1cAPUTYrMg,90222
38
+ moleditpy_linux/modules/move_group_dialog.py,sha256=MVVdy0R-HIHcsCWD2yBVDWoDN4NFXPkOc72dq9laBP4,26905
39
+ moleditpy_linux/modules/periodic_table_dialog.py,sha256=slh1X-6YidaQGzQamrKJ6aetIMKTQLRlBfaAH6B6qfw,3737
40
+ moleditpy_linux/modules/planarize_dialog.py,sha256=u8IZGUEIXnVrBOXBqJefQpFqz3wiU6oLXp4gBNcC7Iw,8402
41
+ moleditpy_linux/modules/settings_dialog.py,sha256=ylofChBPAvUH-wkn_UGNqinYkKoEQKULis8i80Wzh9Y,58264
42
+ moleditpy_linux/modules/template_preview_item.py,sha256=KDuLEZpPSMm9ZB0z5ms8LZyHbFKvszemG0XnR5vi0qg,6404
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+ moleditpy_linux/modules/template_preview_view.py,sha256=AXUaFJR0E1yX9dBY9IDbxYNsBTcRFZWnDwpS_pRZXhs,3081
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+ moleditpy_linux/modules/translation_dialog.py,sha256=gIG_mz4wc4y4ZNq02Ql33ek6B-DrOf1pdWF3FsViCT4,14394
45
+ moleditpy_linux/modules/user_template_dialog.py,sha256=VhLh7MNbElySnAIHjkiRaYLRHJLeK-NcHtAX5yqjBzI,27955
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+ moleditpy_linux/modules/zoomable_view.py,sha256=ZgAmmWXIKtx7AhMjs6H6PCyvb_kpYuankf8UxsZX9mg,4569
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+ moleditpy_linux/modules/assets/icon.icns,sha256=wD5R6-Vw7K662tVKhu2E1ImN0oUuyAP4youesEQsn9c,139863
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+ moleditpy_linux/modules/assets/icon.ico,sha256=RfgFcx7-dHY_2STdsOQCQziY5SNhDr3gPnjO6jzEDPI,147975
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+ moleditpy_linux/modules/assets/icon.png,sha256=kCFN1WacYIdy0GN6SFEbNA00ef39pCczBnFdkkBI8Bs,147110
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+ moleditpy_linux-1.16.1a3.dist-info/METADATA,sha256=HNzP5MU9NSJUXdXDMkEME57oFZytrmYtKyeRs_A2jD0,17437
51
+ moleditpy_linux-1.16.1a3.dist-info/WHEEL,sha256=_zCd3N1l69ArxyTb8rzEoP9TpbYXkqRFSNOD5OuxnTs,91
52
+ moleditpy_linux-1.16.1a3.dist-info/entry_points.txt,sha256=-OzipSi__yVwlimNtu3eiRP5t5UMg55Cs0udyhXYiyw,60
53
+ moleditpy_linux-1.16.1a3.dist-info/top_level.txt,sha256=qyqe-hDYL6CXyin9E5Me5rVl3PG84VqiOjf9bQvfJLs,16
54
+ moleditpy_linux-1.16.1a3.dist-info/RECORD,,
@@ -0,0 +1 @@
1
+ moleditpy_linux
@@ -1,51 +0,0 @@
1
- moleditpy-linux/__init__.py,sha256=QCzpw3P5V_CwDtN4itK4hT9J99JgsH4gmpTfvuus6p8,46
2
- moleditpy-linux/__main__.py,sha256=az0UrbFsuprbQYycF_bSUXxb0F20DuLvYxrZl1-X5EU,831
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- moleditpy-linux/main.py,sha256=cEZJuCL0HrLPUYvuwPSxgUkaDykVb573A-3qVvjF9RM,1180
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- moleditpy-linux/modules/__init__.py,sha256=DIO4nzCCnpeYLjFqzHxcRYqbECtWWMEGQ_-sb03jirs,1127
5
- moleditpy-linux/modules/about_dialog.py,sha256=_M-8MLGXCDtVd7NW8xtglASOiIWTF7HzO8J8AzMubs0,3419
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- moleditpy-linux/modules/align_plane_dialog.py,sha256=D6E0_rM75rKirDkvkJ-diRqNkf8IguqBBLQqDvZJHME,11665
7
- moleditpy-linux/modules/alignment_dialog.py,sha256=tS2_5-wnJRDhLcWtPm9-HUm4_v4bAr53EjV82vydA-k,11140
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- moleditpy-linux/modules/analysis_window.py,sha256=asSCm7bgDW00tGaXSwEN17j-de_BN7ql6iwmxb3f54E,9134
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- moleditpy-linux/modules/angle_dialog.py,sha256=_xwp8CyBEB309UEY618o065Hfqx-XZQHYFXa0fYeNNs,17548
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- moleditpy-linux/modules/atom_item.py,sha256=NSRO4x_5Ciq1Hnt2lfdjtVGGjuZ6iUt2bZ8NGT9FqIg,15297
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- moleditpy-linux/modules/bond_item.py,sha256=zjQHa4vb8xhS9B7cYPRM0nak-f7lr5NQ1uAj_J78ah4,12778
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- moleditpy-linux/modules/bond_length_dialog.py,sha256=xlx-bU3tVeLfShdVRw6_Geo5Gl9mztlIfTdT9tJ6WMA,14579
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- moleditpy-linux/modules/calculation_worker.py,sha256=detE48BW08a2tvmKjMgz8zCShgARzsRH-ABmWrPcqZA,42055
14
- moleditpy-linux/modules/color_settings_dialog.py,sha256=h4AOKU8dCTenecI8zOM9GfnmKDm7jfe5C4Fa23Budvs,15205
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- moleditpy-linux/modules/constants.py,sha256=rncfyD-EbegEYA8IeIGYrFm2KHAMKPfiEUQKbA3st1o,4436
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- moleditpy-linux/modules/constrained_optimization_dialog.py,sha256=MlWnPze0JJvnqmHx9n3qZWG_h-2kZymT0PQ6lALbCro,29861
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- moleditpy-linux/modules/custom_interactor_style.py,sha256=K_uGM6FezY0kZ3zPqoR6f0nowG40ytt-L4UCAbPlwGM,38184
18
- moleditpy-linux/modules/custom_qt_interactor.py,sha256=6mzaVb3Mhp-4nryG5AraEvPPgBJpotrzVYwrpCAKmVo,2186
19
- moleditpy-linux/modules/dialog3_d_picking_mixin.py,sha256=gaF1ATevvvF72aBfAjubRcagT2jnVG5RMpEKos_XdKg,4768
20
- moleditpy-linux/modules/dihedral_dialog.py,sha256=H6WFvc7NvPHSd5QCMk0NUPhudOzpModXv-42dYL20KM,17809
21
- moleditpy-linux/modules/main_window.py,sha256=Ii36JTPSkZNaqqEc8CXZ1bq9accIMg5yUs1U7_pHgYM,35791
22
- moleditpy-linux/modules/main_window_app_state.py,sha256=f9f3JVuC46ijlea2DR8ADa0Jn5r2dgedPPdg8OkmNAU,33374
23
- moleditpy-linux/modules/main_window_compute.py,sha256=fiIokVvjzXIwwR3FV3Ltet_K4oL_rT0Z27rPMbvlyyc,51346
24
- moleditpy-linux/modules/main_window_dialog_manager.py,sha256=5WU6mFABB0aI4XCywP-cLFPkNQSb3bC0OK0I28SQG_w,19845
25
- moleditpy-linux/modules/main_window_edit_3d.py,sha256=FStBWVeDVAM2MoO-JCTjPM-G7iT8QZUHxsb0dS4MEAI,19553
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- moleditpy-linux/modules/main_window_edit_actions.py,sha256=8tR0rYfgWYgdKTxBP4snzpxhiD2DExSKyf4jzSWb6sE,64598
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@@ -1 +0,0 @@
1
- moleditpy-linux
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