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Micelle_Shape_Identifier/README.txt
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################################################################# | |
Things needed to install: | |
matplotlib: install using python3 -m pip install -U matplotlib | |
scipy: pip3 install --user scipy | |
cython | |
python-tk: on Linux- sudo apt-get install python3-tk | |
pyffi: pip3 install --user pyffi | |
################################################################# | |
To run- you must use Python3 (ideally Python 3.7): | |
1. Running the identifier: python micelle_identifier.py -m micelle_file.txt -a connection_file.txt | |
a. The output will be the text specifying the micelle shape identified and a visual plot of the points | |
The above files do not need to be in a ".txt" format. Any file will suffice. | |
################################################################# | |
To build the documentation: | |
0. Install Doyxgen and graphviz: sudo apt-get install doxygen graphviz | |
1. Run the following: doxygen doxyfile | |
2. Open the docs/html folder and click on the index.html file to view in a browser |