moleditpy 0.3.0__tar.gz → 0.3.2__tar.gz

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@@ -1,6 +1,6 @@
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  Metadata-Version: 2.4
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  Name: moleditpy
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- Version: 0.3.0
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+ Version: 0.3.2
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  Summary: A program to edit molecular structures using Python.
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  Author-email: HiroYokoyama <titech.yoko.hiro@gmail.com>
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  Project-URL: Homepage, https://github.com/HiroYokoyama/python_molecular_editor
@@ -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 = "0.3.0"
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+ version = "0.3.2"
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  authors = [
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  { name="HiroYokoyama", email="titech.yoko.hiro@gmail.com" },
@@ -45,4 +45,4 @@ Issues = "https://github.com/HiroYokoyama/python_molecular_editor/issues"
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  moleditpy = "moleditpy.main:main"
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  [tool.setuptools.package-data]
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- "moleditpy" = ["assets/icon.png"]
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+ "moleditpy" = ["assets/*"]
@@ -87,7 +87,8 @@ def main():
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  ctypes.windll.shell32.SetCurrentProcessExplicitAppUserModelID(myappid)
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  app = QApplication(sys.argv)
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- window = MainWindow()
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+ file_path = sys.argv[1] if len(sys.argv) > 1 else None
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+ window = MainWindow(initial_file=file_path)
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  window.show()
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  sys.exit(app.exec())
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@@ -1511,7 +1512,7 @@ class AnalysisWindow(QDialog):
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  class MainWindow(QMainWindow):
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  start_calculation = pyqtSignal(str)
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- def __init__(self):
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+ def __init__(self, initial_file=None):
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  super().__init__()
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  self.setWindowTitle("moleditpy -- Python Molecular Editor by HY"); self.setGeometry(100, 100, 1400, 800)
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  self.data = MolecularData(); self.current_mol = None
@@ -1527,6 +1528,9 @@ class MainWindow(QMainWindow):
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  QApplication.clipboard().dataChanged.connect(self.update_edit_menu_actions)
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  self.update_edit_menu_actions()
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+ if initial_file:
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+ self.load_raw_data(file_path=initial_file)
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+
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  def init_ui(self):
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  # 1. 現在のスクリプトがあるディレクトリのパスを取得
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  script_dir = os.path.dirname(os.path.abspath(__file__))
@@ -2425,10 +2429,12 @@ class MainWindow(QMainWindow):
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  self.statusBar().showMessage(f"Project saved to {file_path}")
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  except Exception as e: self.statusBar().showMessage(f"Error saving project file: {e}")
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- def load_raw_data(self):
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- options = QFileDialog.Option.DontUseNativeDialog
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- file_path, _ = QFileDialog.getOpenFileName(self, "Open Project File", "", "Project Files (*.pmeraw);;All Files (*)", options=options)
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- if not file_path: return
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+ def load_raw_data(self, file_path=None):
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+ if not file_path:
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+ options = QFileDialog.Option.DontUseNativeDialog
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+ file_path, _ = QFileDialog.getOpenFileName(self, "Open Project File", "", "Project Files (*.pmeraw);;All Files (*)", options=options)
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+ if not file_path: return
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+
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  try:
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  with open(file_path, 'rb') as f: loaded_data = pickle.load(f)
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  self.set_state_from_data(loaded_data)
@@ -1,6 +1,6 @@
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  Metadata-Version: 2.4
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  Name: moleditpy
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- Version: 0.3.0
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+ Version: 0.3.2
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  Summary: A program to edit molecular structures using Python.
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  Author-email: HiroYokoyama <titech.yoko.hiro@gmail.com>
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  Project-URL: Homepage, https://github.com/HiroYokoyama/python_molecular_editor
@@ -8,4 +8,5 @@ src/moleditpy.egg-info/dependency_links.txt
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  src/moleditpy.egg-info/entry_points.txt
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  src/moleditpy.egg-info/requires.txt
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  src/moleditpy.egg-info/top_level.txt
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+ src/moleditpy/assets/icon.ico
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  src/moleditpy/assets/icon.png
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