PyGauss
Installation
OSX and Linux
Windows
Troubleshooting
Testing
Example Assessment
Single Molecule Analysis
Multiple Computations Analysis
Project Status
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Development
Whats New
v0.4.3 - Coninuous Integrated Testing
v0.4.2 - Addition of Documentation
v0.4.0 - Major Update
v0.3.0 - File Input Over SSH
v0.2.2 - Table Image Improvements
v0.2.1 - Latex Table Images
v0.2 - Initial working distribution
v0.1 - First Version
Whats To Come
Natural Bonding Orbital Visualisation
Density of State analysis
Option to turn off perspective in images
Improve wireframe view for molecules
labelling molecule images
add docx output
User API
pygauss.file_io module
pygauss.molecule module
pygauss.analysis module
pygauss.isosurface module
pygauss.utils module
PyGauss
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v: v0.4.3
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