![](https://molecularmachinelearning.com/wp-content/uploads/2023/04/de_novo_cropped-1024x1024.png)
![](https://molecularmachinelearning.com/wp-content/uploads/2023/04/MML-homepage-logo-1024x313.png)
Artificial intelligence for drug discovery at the Eindhoven University of Technology
OUR MISSION
Augmenting human intelligence in drug discovery with meaningful innovation in AI
Discovering innovative molecules with the desired bioactivity is an essential step to develop new drugs and gather a greater understanding of biological systems. Machine learning bears promise to accelerate the molecule discovery pipeline, by allowing for a time- and cost-efficient navigation of the incredibly vast chemical universe.
Read MoreOUR TEAM
We are an interdisciplinary team of passionate people who bring together chemistry, biology and AI to tackle the complex challenges in this field. Meet our exceptional team members below and discover how their unique skills and perspectives contribute to our mission.
Read MoreRESEARCH
![](https://molecularmachinelearning.com/wp-content/uploads/2023/04/de_novo_cropped-1024x1024.png)
![](https://molecularmachinelearning.com/wp-content/uploads/2023/04/Picture-1-1.png)
Molecular property prediction
![](https://molecularmachinelearning.com/wp-content/uploads/2023/04/MML-homepage-research-img3@2x.png)
Prospective applications
![](https://molecularmachinelearning.com/wp-content/uploads/2023/04/MML-Publications-Github@2x.png)
SHARING CODE
In the Molecular Machine learning team, we believe in the importance of open and reproducible research. Check out our GitHub repository for freely-available code!
Go To GithubPUBLICATIONS
Our group of scientists is always busy writing and publishing. Please click further to get an overview of all of our publications.
Read More![logo](https://molecularmachinelearning.com/wp-content/themes/mml_template/images/MML-homepage-logo-footer.png)
![](https://molecularmachinelearning.com/wp-content/uploads/2023/04/MML-logos-TU-e-300x114.png)
![](https://molecularmachinelearning.com/wp-content/uploads/2023/04/MML-logos-ERC.png)
![](https://molecularmachinelearning.com/wp-content/uploads/2023/04/MML-logos-ICMS-300x136.png)
![](https://molecularmachinelearning.com/wp-content/uploads/2023/04/MML-logos-CFLT-300x141.png)
![](https://molecularmachinelearning.com/wp-content/uploads/2023/04/MML-MSCA.png)