This repo contains the building material for a JupyterBook which is intended to serve as a template/prototype for the hands-on part of a Machine Learning in Chemical Engineering (MLCE) course. This was a collective effort between the Process Systems Engineering group at the Otto von Guericke University / MPI Magdeburg and the Optimisation and Machine Learning for Process Systems Engineering group at Imperial College London to share experiences and material used in the respective MLCE courses offered in these institutions.

The book aims at covering application case-studies in chemical engineering of

• Supervised learning
• Unsupervised learning
• Reinforcement learning
• Data-driven optimization
• Hybrid modelling

If you have nice tutorials in the areas mentioned above reflecting case-studies in chemical engineering, we encourage you to share it with the community! 💪 For practical reasons, it is better if you submit your pull-request including a link to a working Colab Notebook.

Let us know! Submit your issue here and we will fix it. We encourage you to contribute to this resource!

To cite this JupyterBook use

@book{sanchez_chanona_ganzer_2023,
    title = {Machine Learning in Chemical Engineering},
    author = {Sanchez Medina, Edgar Ivan and del Rio Chanona, Ehecatl Antonio and Ganzer, Caroline},
    year = {2023},
    publisher = {JupyterBook},
    url = {https://edgarsmdn.github.io/MLCE_book/},
    DOI = {10.5281/zenodo.7986905}
}

or perhaps the more conventional:

• Sanchez Medina, Edgar Ivan, del Rio Chanona, Ehecatl Antonio, & Ganzer, Caroline. (2023). Machine Learning in Chemical Engineering (v1.0.0). Zenodo. https://doi.org/10.5281/zenodo.7986905