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A package for modelling diffusion processes.

Project description

Multi-Diffusion Domain Model Toolkit (mddtoolkit)

This app does things.

Table of Contents

Installation

  1. Run pip install -e . in the root directory of the repository to install the package and its dependencies
  2. Dance

Usage

Quick Start

example cli call:

fit_MDD_model \
    -i path_to/diffusion_code_final/example/tests/N13ksp_python_test.csv \
    -c path_to/diffusion_code_final/example/tests/test.yaml \
    -o /Users/josh/repos/ diffusion_code_final/output/test_final

example yaml file:

domains_to_model: [1,8]

lnd0aa_bounds:
- -5.0
- 50.0

ea_bounds:
- 50.0
- 500.0

geometry: plane sheet
omit_value_indices: []
punish_degas_early: true 

Support

Please open an issue for support.

Contributing

Please contribute using Github Flow. Create a branch, add commits, and open a pull request.

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