You're reading the documentation for a development version. For the latest released version, please have a look at v4.4.0.
A CADET installation consists of two parts: The CADET core simulator and a frontend.
Install CADET core simulator¶
The core simulator can be compiled from source, or you can download pre-built binaries. If you want to extend or modify CADET (e.g., add a custom binding model), you will need to build CADET from source.
Install pre-built binaries¶
CADET can be installed via conda from the
conda install -c conda-forge cadet
This requires a working conda installation.
Optionally, use mamba which uses a faster dependency solver than
mamba install -c conda-forge cadet
Install from source¶
Install a frontend¶
As of now, a MATLAB and a Python frontend are provided. In general, we recommend to use the Python frontend. Note that the MATLAB interface is no longer actively developed and will be deprecated in a later version.
The easiest way to create CADET simulations is to use the CADET-Python frontend. For this purpose, we recommend installing Anaconda. Anaconda is a high-performance scientific distribution of Python that includes many common packages needed for scientific and engineering work. Download the installer from their website and run it for the local user.
CADET-Python, open an Anaconda Shell and execute:
pip install cadet-python
If you would also like to use CADET-Match for parameter estimation, run:
pip install cadetmatch
Note that the MATLAB interface is no longer actively developed and will be deprecated in a later version.
The MATLAB frontend is distributed with the pre-built binaries.
Run MATLAB and call
installCADET() in the command window.