Building the future of molecular research
A European repository for biosimulation data
The MDDB Project
Your gateway to comprehensive molecular dynamics data
At MDDB we are harnessing decades of cutting-edge computational resources to build a unified database that compiles and organises all data generated by molecular dynamics simulations. By making these data accessible to a wider scientific community, we hope to drive new research and discoveries in fields such as biochemistry, pharmacology, and personalized medicine.

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The latest insights from our project
Webinar: DynaRepo and beyond: Computational tools to decode dynamics and interactions in macromolecular complexes
In this webinar session, Dr Yasaman Karami and Dr Hamed Khakzad from Inria, University of Lorraine, France, together with Dr Roy [...]
Workshop: Role of MD in drug discovery
We are pleased to announce our upcoming workshop, taking place from September 29 to October 1, 2025, in the [...]
New webinar recording: MemProtMD and its role in the MDDB project
We are pleased to announce that the recording of our recent webinar, "MemProtMD: A Database of Membrane Protein Simulations" [...]