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A cDFT-PC-SAFT package in Python using PyTorch

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Name		Name	Last commit message	Last commit date
Latest commit History 56 Commits
cdft		cdft
examples		examples
.gitignore		.gitignore
README.md		README.md
setup.py		setup.py

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LJS-cDFT: A classical Density Functional Theory package

Express installation

pip install git+https://github.com/lucas-j-santos/LJS-cDFT.git

online example

example 1 hue br

Local dev installation

git clone https://github.com/lucas-j-santos/LJS-cDFT.git

cd LJS-cDFT
pip install -e .

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A cDFT-PC-SAFT package in Python using PyTorch

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