moleditpy 1.2.4__tar.gz → 1.2.6__tar.gz

{moleditpy-1.2.4 → moleditpy-1.2.6}/PKG-INFO

@@ -1,6 +1,6 @@
 Metadata-Version: 2.4
 Name: moleditpy
-Version: 1.2.4
+Version: 1.2.6
 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.
 Author-email: HiroYokoyama <titech.yoko.hiro@gmail.com>
 Project-URL: Homepage, https://github.com/HiroYokoyama/python_molecular_editor

{moleditpy-1.2.4 → moleditpy-1.2.6}/pyproject.toml

@@ -5,7 +5,7 @@ build-backend = "setuptools.build_meta"
 [project]
 name = "moleditpy"
 
-version = "1.2.4"
+version = "1.2.6"
 
 authors = [
   { name="HiroYokoyama", email="titech.yoko.hiro@gmail.com" },

{moleditpy-1.2.4 → moleditpy-1.2.6}/src/moleditpy/main.py

@@ -11,7 +11,7 @@ DOI 10.5281/zenodo.17268532
 """
 
 #Version
-VERSION = '1.2.4'
+VERSION = '1.2.6'
 
 print("-----------------------------------------------------")
 print("MoleditPy — A Python-based molecular editing software")
@@ -41,7 +41,7 @@ from PyQt6.QtGui import (
     QPen, QBrush, QColor, QPainter, QAction, QActionGroup, QFont, QPolygonF,
     QPainterPath, QPainterPathStroker, QFontMetrics, QFontMetricsF, QKeySequence, QTransform, QCursor, QPixmap, QIcon, QShortcut, QDesktopServices
 )
-from PyQt6.QtCore import Qt, QPointF, QRectF, QLineF, QObject, QThread, pyqtSignal, QEvent, QMimeData, QByteArray, QUrl
+from PyQt6.QtCore import Qt, QPointF, QRectF, QLineF, QObject, QThread, pyqtSignal, QEvent, QMimeData, QByteArray, QUrl, QTimer
 
 from vtkmodules.vtkInteractionStyle import vtkInteractorStyleTrackballCamera
 
@@ -3070,6 +3070,7 @@ class MainWindow(QMainWindow):
             try:
                 self.current_mol = Chem.Mol(loaded_data['mol_3d'])
                 self.draw_molecule_3d(self.current_mol)
+                self.plotter.reset_camera()
                 self.analysis_action.setEnabled(True)
                 self.optimize_3d_button.setEnabled(True)
                 self.export_button.setEnabled(True)
@@ -3321,7 +3322,7 @@ class MainWindow(QMainWindow):
 
             self.statusBar().showMessage(f"Successfully loaded from SMILES.")
             self.reset_undo_stack()
-            self.fit_to_view()
+            QTimer.singleShot(0, self.fit_to_view)
         except Exception as e:
             self.statusBar().showMessage(f"Error loading from SMILES: {e}")
 
@@ -3388,8 +3389,8 @@ class MainWindow(QMainWindow):
                 self.scene.create_bond(a1_item, a2_item, bond_order=int(b_type), bond_stereo=stereo)
 
             self.statusBar().showMessage(f"Successfully loaded {file_path}")
-            self.fit_to_view()
             self.reset_undo_stack()
+            QTimer.singleShot(0, self.fit_to_view)
         except Exception as e: self.statusBar().showMessage(f"Error loading file: {e}")
 
     def save_raw_data(self):
@@ -3415,6 +3416,7 @@ class MainWindow(QMainWindow):
             self.set_state_from_data(loaded_data)
             self.statusBar().showMessage(f"Project loaded from {file_path}")
             self.reset_undo_stack()
+            QTimer.singleShot(0, self.fit_to_view)
         except Exception as e: self.statusBar().showMessage(f"Error loading project file: {e}")
 
     def save_as_mol(self):

{moleditpy-1.2.4 → moleditpy-1.2.6}/src/moleditpy.egg-info/PKG-INFO

@@ -1,6 +1,6 @@
 Metadata-Version: 2.4
 Name: moleditpy
-Version: 1.2.4
+Version: 1.2.6
 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.
 Author-email: HiroYokoyama <titech.yoko.hiro@gmail.com>
 Project-URL: Homepage, https://github.com/HiroYokoyama/python_molecular_editor