Polycomp

Python implmentation of polymer field theories with complex Langevin integration for determining structure of polymer melts. Particular focus on polyelectrolytes. Still under construction.

install with

pip install . 

You can find all of the required packages prepared in a single conda environment which can be installed via

conda env create --file polycomp.yml

The package will also require a working CUDA installation.

Running the tests You can make sure that your installation has worked by running

python tests.py

from the tests directory.

Full documentation is available and will continue to be udated as we improve the code