MoleditPy 3.0.3__tar.gz → 3.0.4__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. {moleditpy-3.0.3 → moleditpy-3.0.4}/PKG-INFO +1 -1
  2. {moleditpy-3.0.3 → moleditpy-3.0.4}/pyproject.toml +1 -1
  3. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/MoleditPy.egg-info/PKG-INFO +1 -1
  4. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/view_3d_logic.py +2 -2
  5. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/utils/constants.py +1 -1
  6. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/utils/default_settings.py +1 -1
  7. {moleditpy-3.0.3 → moleditpy-3.0.4}/LICENSE +0 -0
  8. {moleditpy-3.0.3 → moleditpy-3.0.4}/README.md +0 -0
  9. {moleditpy-3.0.3 → moleditpy-3.0.4}/setup.cfg +0 -0
  10. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/MoleditPy.egg-info/SOURCES.txt +0 -0
  11. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/MoleditPy.egg-info/dependency_links.txt +0 -0
  12. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/MoleditPy.egg-info/entry_points.txt +0 -0
  13. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/MoleditPy.egg-info/requires.txt +0 -0
  14. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/MoleditPy.egg-info/top_level.txt +0 -0
  15. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/__init__.py +0 -0
  16. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/__main__.py +0 -0
  17. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/assets/file_icon.ico +0 -0
  18. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/assets/icon.icns +0 -0
  19. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/assets/icon.ico +0 -0
  20. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/assets/icon.png +0 -0
  21. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/core/__init__.py +0 -0
  22. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/core/mol_geometry.py +0 -0
  23. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/core/molecular_data.py +0 -0
  24. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/main.py +0 -0
  25. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/plugins/__init__.py +0 -0
  26. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/plugins/plugin_interface.py +0 -0
  27. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/plugins/plugin_manager.py +0 -0
  28. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/plugins/plugin_manager_window.py +0 -0
  29. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/__init__.py +0 -0
  30. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/about_dialog.py +0 -0
  31. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/align_plane_dialog.py +0 -0
  32. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/alignment_dialog.py +0 -0
  33. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/analysis_window.py +0 -0
  34. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/angle_dialog.py +0 -0
  35. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/app_state.py +0 -0
  36. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/atom_item.py +0 -0
  37. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/base_picking_dialog.py +0 -0
  38. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/bond_item.py +0 -0
  39. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/bond_length_dialog.py +0 -0
  40. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/calculation_worker.py +0 -0
  41. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/color_settings_dialog.py +0 -0
  42. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/compute_logic.py +0 -0
  43. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/constrained_optimization_dialog.py +0 -0
  44. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/custom_interactor_style.py +0 -0
  45. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/custom_qt_interactor.py +0 -0
  46. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/dialog_3d_picking_mixin.py +0 -0
  47. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/dialog_logic.py +0 -0
  48. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/dihedral_dialog.py +0 -0
  49. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/edit_3d_logic.py +0 -0
  50. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/edit_actions_logic.py +0 -0
  51. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/export_logic.py +0 -0
  52. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/geometry_base_dialog.py +0 -0
  53. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/io_logic.py +0 -0
  54. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/main_window.py +0 -0
  55. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/main_window_init.py +0 -0
  56. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/mirror_dialog.py +0 -0
  57. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/molecular_scene_handler.py +0 -0
  58. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/molecule_scene.py +0 -0
  59. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/move_group_dialog.py +0 -0
  60. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/periodic_table_dialog.py +0 -0
  61. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/planarize_dialog.py +0 -0
  62. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/settings_dialog.py +0 -0
  63. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/settings_tabs/__init__.py +0 -0
  64. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/settings_tabs/settings_2d_tab.py +0 -0
  65. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/settings_tabs/settings_3d_tabs.py +0 -0
  66. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/settings_tabs/settings_other_tab.py +0 -0
  67. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/settings_tabs/settings_tab_base.py +0 -0
  68. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/sip_isdeleted_safe.py +0 -0
  69. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/string_importers.py +0 -0
  70. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/template_preview_item.py +0 -0
  71. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/template_preview_view.py +0 -0
  72. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/translation_dialog.py +0 -0
  73. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/ui_manager.py +0 -0
  74. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/user_template_dialog.py +0 -0
  75. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/zoomable_view.py +0 -0
  76. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/utils/__init__.py +0 -0
  77. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/utils/sip_isdeleted_safe.py +0 -0
  78. {moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/utils/system_utils.py +0 -0
{moleditpy-3.0.3 → moleditpy-3.0.4}/PKG-INFO RENAMED
@@ -1,6 +1,6 @@
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  Metadata-Version: 2.4
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  Name: MoleditPy
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- Version: 3.0.3
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+ Version: 3.0.4
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  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.
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  Author-email: HiroYokoyama <titech.yoko.hiro@gmail.com>
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  License: GNU GENERAL PUBLIC LICENSE
{moleditpy-3.0.3 → moleditpy-3.0.4}/pyproject.toml RENAMED
@@ -5,7 +5,7 @@ build-backend = "setuptools.build_meta"
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  [project]
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  name = "MoleditPy"
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- version = "3.0.3"
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+ version = "3.0.4"
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  license = {file = "LICENSE"}
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{moleditpy-3.0.3 → moleditpy-3.0.4}/src/MoleditPy.egg-info/PKG-INFO RENAMED
@@ -1,6 +1,6 @@
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  Metadata-Version: 2.4
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  Name: MoleditPy
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- Version: 3.0.3
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+ Version: 3.0.4
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  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.
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  Author-email: HiroYokoyama <titech.yoko.hiro@gmail.com>
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  License: GNU GENERAL PUBLIC LICENSE
{moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/ui/view_3d_logic.py RENAMED
@@ -175,7 +175,7 @@ class View3DManager:
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  self._3d_color_map.clear()
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  # 1. Camera state and clear
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- camera_state = self.host.view_3d_manager.plotter.camera.copy()
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+ camera_state = self.host.view_3d_manager.plotter.camera_position
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  # Force removal to prevent ghost actor residues
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  old_axes_actor = getattr(self, "axes_actor", None)
@@ -279,7 +279,7 @@ class View3DManager:
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  self._add_3d_bond_cylinders(mol_to_draw, conf, col, current_style, mesh_props)
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  self._add_3d_aromatic_rings(mol_to_draw, current_style, mesh_props)
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  self._add_3d_labels(mol, mol_to_draw)
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- self.host.view_3d_manager.plotter.camera = camera_state
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+ self.host.view_3d_manager.plotter.camera_position = camera_state
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  # Update projection mode and force render
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  settings = getattr(self, "settings", {})
{moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/utils/constants.py RENAMED
@@ -16,7 +16,7 @@ from PyQt6.QtGui import QColor, QFont
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  from rdkit import Chem
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  # Version
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- VERSION = "3.0.3"
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+ VERSION = "3.0.4"
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  ATOM_RADIUS = 18
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  BOND_OFFSET = 3.5
{moleditpy-3.0.3 → moleditpy-3.0.4}/src/moleditpy/utils/default_settings.py RENAMED
@@ -53,7 +53,7 @@ DEFAULT_SETTINGS = {
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  "display_aromatic_circles_3d": False,
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  "display_kekule_3d": False,
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  # --- 3D Conversion and Optimization ---
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- "3d_conversion_mode": "rdkit",
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+ "3d_conversion_mode": "fallback",
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  "optimization_method": "MMFF_RDKIT",
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  "optimize_intermolecular_interaction_rdkit": True,
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  "skip_chemistry_checks": False,
{moleditpy-3.0.3 → moleditpy-3.0.4}/LICENSE RENAMED
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{moleditpy-3.0.3 → moleditpy-3.0.4}/README.md RENAMED
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{moleditpy-3.0.3 → moleditpy-3.0.4}/setup.cfg RENAMED
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