cnotebook 1.1.0__py3-none-any.whl → 1.2.0__py3-none-any.whl

cnotebook/__init__.py

@@ -8,7 +8,7 @@ from .render import render_molecule_grid
 # to avoid confusion
 from cnotebook.pandas_ext import register_pandas_formatters as _register_pandas_formatters
 
-__version__ = '1.1.0'
+__version__ = '1.2.0'
 
 ###########################################
 

{cnotebook-1.1.0.dist-info → cnotebook-1.2.0.dist-info}/METADATA

@@ -1,6 +1,6 @@
 Metadata-Version: 2.4
 Name: cnotebook
-Version: 1.1.0
+Version: 1.2.0
 Summary: Chemistry visualization in Jupyter Notebooks with the OpenEye Toolkits
 Author-email: Scott Arne Johnson <scott.arne.johnson@gmail.com>
 License-Expression: MIT
@@ -23,12 +23,12 @@ Classifier: Programming Language :: Python :: 3 :: Only
 Classifier: Operating System :: OS Independent
 Classifier: Framework :: Jupyter
 Classifier: Framework :: IPython
-Requires-Python: >=3.10
+Requires-Python: >=3.11
 Description-Content-Type: text/markdown
 License-File: LICENSE
-Requires-Dist: pandas<3.0.0,>=2.0.0
+Requires-Dist: pandas>=2.2.0
 Requires-Dist: oepandas>=2.0.0
-Requires-Dist: openeye-toolkits
+Requires-Dist: openeye-toolkits>=2025.2.1
 Provides-Extra: dev
 Requires-Dist: invoke; extra == "dev"
 Requires-Dist: build; extra == "dev"
@@ -38,7 +38,12 @@ Requires-Dist: pytest; extra == "test"
 Requires-Dist: pytest-cov; extra == "test"
 Dynamic: license-file
 
-# CNotebook - Chemistry Visualization for Jupyter & Marimo
+# CNotebook
+
+[![Python 3.11+](https://img.shields.io/badge/python-3.11+-blue.svg)](https://www.python.org/downloads/)
+[![OpenEye Toolkits](https://img.shields.io/badge/OpenEye-2025.2.1+-green.svg)](https://www.eyesopen.com/toolkits)
+[![Pandas 2.2+](https://img.shields.io/badge/pandas-2.2+-orange.svg)](https://pandas.pydata.org/)
+
 
 **Author:** Scott Arne Johnson ([scott.arne.johnson@gmail.com](mailto:scott.arne.johnson@gmail.com))
 
@@ -70,33 +75,33 @@ mol
 
 That's it! CNotebook automatically registers formatters so that OpenEye molecule objects display as chemical structures instead of cryptic text representations.
 
-## 📚 Features
+## Features
 
-### ✨ Automatic Rendering
+### Automatic Rendering
 - **Zero Configuration**: Just import and go - molecules automatically render as structures
 - **Multiple Formats**: Supports both Jupyter Notebooks and Marimo environments
 - **Smart Detection**: Automatically detects your notebook environment
 
-### 🧪 Molecule Support
+### Molecule Support
 - **OEMol Objects**: Direct rendering of `oechem.OEMolBase` derived objects
 - **OE2DMolDisplay**: Advanced rendering with custom depiction options
 - **Pandas Integration**: Seamless rendering in DataFrames with oepandas
 
-### 🎨 Visualization Options
+### Visualization Options
 - **Multiple Formats**: PNG (default) or SVG output
 - **Customizable Sizing**: Configurable width, height, and scaling
 - **Grid Layouts**: Multi-molecule grid displays
 - **Substructure Highlighting**: SMARTS pattern highlighting
 - **Molecular Alignment**: Align molecules to reference structures
 
-### 📊 Pandas Integration
+### Pandas Integration
 - **DataFrame Rendering**: Automatic molecule column detection and rendering
 - **Column Highlighting**: Highlight different patterns per row
 - **Alignment Tools**: Align molecular depictions in DataFrames
 - **Fingerprint Similarity**: Visual similarity coloring
 - **Property Calculation**: Chemistry-aware DataFrame operations
 
-## 🛠️ Environment Support
+## Environment Support
 
 ### Jupyter Notebooks
 CNotebook automatically integrates with Jupyter when imported:
@@ -126,7 +131,7 @@ oechem.OESmilesToMol(mol, "c1ccccc1")
 mol  # Automatically renders as PNG for Marimo compatibility
 ```
 
-## 📖 Advanced Usage
+## Advanced Usage
 
 ### Rendering Configuration
 
@@ -204,7 +209,7 @@ df.fingerprint_similarity("Molecule", reference_mol, inplace=True)
 df  # Shows similarity coloring and Tanimoto coefficients
 ```
 
-## 📁 Demo Notebooks
+## Demo Notebooks
 
 Explore comprehensive examples in the `demos/` directory:
 
@@ -228,7 +233,7 @@ Explore comprehensive examples in the `demos/` directory:
 - High-quality crisp molecular graphics
 - SVG compatibility considerations
 
-## 🔧 Configuration Options
+## Configuration Options
 
 ### Global Context Settings
 
@@ -254,7 +259,7 @@ ctx.scale = 1.0          # Scaling factor
 - **Marimo**: Automatically uses PNG format for compatibility
 - **Console**: Falls back to string representations
 
-## 🤝 Contributing
+## Contributing
 
 We welcome contributions! Please ensure your code:
 - Follows existing code style and conventions
@@ -262,11 +267,11 @@ We welcome contributions! Please ensure your code:
 - Works with both Jupyter and Marimo environments
 - Maintains compatibility with OpenEye Toolkits
 
-## 📄 License
+## License
 
 This project is licensed under the MIT License. See the [LICENSE](LICENSE) file for details.
 
-## 🐛 Issues & Support
+## Issues & Support
 
 For bug reports, feature requests, or general support, please open an issue on GitHub or contact the author at [scott.arne.johnson@gmail.com](mailto:scott.arne.johnson@gmail.com).
 

{cnotebook-1.1.0.dist-info → cnotebook-1.2.0.dist-info}/RECORD

@@ -1,4 +1,4 @@
-cnotebook/__init__.py,sha256=jO2L0sjW-5r1GthZ45f8zyhVdhaGBK2hjiGD1q3way4,2702
+cnotebook/__init__.py,sha256=31LjoTU4gu19fgH9g3WGG08Tqopq69mSizz-AUu5WQ8,2702
 cnotebook/align.py,sha256=u22GEHJc8QzCb9If2mjuapKPOTBEB2iu6jtUfgmm1UQ,14086
 cnotebook/context.py,sha256=MXOIIZ7PkWZ8Wi11L00ldAqsaNCBmJRc76bETelIq9w,17493
 cnotebook/helpers.py,sha256=r5-CIcmomd8vbd6ILGU6uW3sAjWZPcng82cikZ0ZDZ8,2193
@@ -6,8 +6,8 @@ cnotebook/ipython_ext.py,sha256=mu9eMQiYFEQeT8pS_xh-8Qx6N4dyn6_9u0YwlEudQXo,1989
 cnotebook/marimo_ext.py,sha256=SPvej9LsRIFz8ljujMjppkm92BWTR8xgX9SqFmkY6VA,7169
 cnotebook/pandas_ext.py,sha256=enGXKWDHOv6TK-MbA2H_KsP2IrAEViftyDvCKIjkTX8,35411
 cnotebook/render.py,sha256=S7N7hPF61tppSAo7WN0kF89pWVJWKVMiDczy7RkOltA,13025
-cnotebook-1.1.0.dist-info/licenses/LICENSE,sha256=HbIgeZz-pWGC7BEnYFCQ-jfD1m_BfiosF9qjgWw64GU,1080
-cnotebook-1.1.0.dist-info/METADATA,sha256=fuK5_QxxkcqisT5x2FPc-_WRnYPsD_6j81KMN0uW68A,8575
-cnotebook-1.1.0.dist-info/WHEEL,sha256=_zCd3N1l69ArxyTb8rzEoP9TpbYXkqRFSNOD5OuxnTs,91
-cnotebook-1.1.0.dist-info/top_level.txt,sha256=jzkieTjQwdNKfMwnoElvDDtNPkeLMjbvWbsbkSsboo8,10
-cnotebook-1.1.0.dist-info/RECORD,,
+cnotebook-1.2.0.dist-info/licenses/LICENSE,sha256=HbIgeZz-pWGC7BEnYFCQ-jfD1m_BfiosF9qjgWw64GU,1080
+cnotebook-1.2.0.dist-info/METADATA,sha256=i1vWVNcomhxVXtOAnsVk2YykR57T3EEeCvJvg91qst8,8789
+cnotebook-1.2.0.dist-info/WHEEL,sha256=_zCd3N1l69ArxyTb8rzEoP9TpbYXkqRFSNOD5OuxnTs,91
+cnotebook-1.2.0.dist-info/top_level.txt,sha256=jzkieTjQwdNKfMwnoElvDDtNPkeLMjbvWbsbkSsboo8,10
+cnotebook-1.2.0.dist-info/RECORD,,