Installation
Currently we only support the installation can be done using the github repository. This will change once this repository is added to MDAKits.
Vitual environment
conda create --name twod
conda activate twod
Tip
conda create command creates a conda environment named twod
and conda activate command starts environment in your terminal.
Whenever you close your terminal, you need to use activate command again to restart environment.
Before start, we strongly recommend the creation of a virtual environment with conda
Installation from github
The following two lines download our repository and go into the directory twdanalysis
git clone https://github.com/monjegroup/twod-analysis-kit.git
cd twod-analysis-kit
Now, once in the directory, install the development and documentation dependencies:
conda env update --name twod --file devtools/conda-envs/test_env.yaml
conda env update --name twod --file docs/requirements.yaml
Finally, build dependencies and twodanalysis current version via pip command
pip install -e .