News SIMPLAIX
Molecular research: When speed meets precision
KIMMDY software visualizes biological processes in motion – conceived and originally developed at HITS, refined and published at the Max Planck Institute …
The molecular research “booster” evolves: SIMPLAIX collaboration starts the next phase
Computer simulations and Artificial Intelligence are the main pillars of the “SIMPLAIX” collaboration, initiated by the Heidelberg Institute for Theoretical Studies (…
Registration now open: 4th SIMPLAIX Workshop on “Machine Learning for Multiscale Molecular Modeling”
The 4th SIMPLAIX Workshop on “Machine Learning for Multiscale Molecular Modeling” will take place in the Studio Villa Bosch in Heidelberg …
3rd SIMPLAIX Workshop: Thanks to all participants!
A big thank you to all the speakers and participants for making the 3rd SIMPLAIX Workshop on “Machine Learning for Multiscale …
PAL: Parallel Active Learning – automated, modular, and parallel active learning workflow
See more here: https://github.com/aimat-lab/PAL
Generating Highly Designable Proteins with Geometric Algebra Flow Matching
Generating structurally diverse and physically realizable protein backbones remains one of the grand challenges in protein design. We propose a generative …
Manfred Fuchs Prize for SIMPLAIX researcher
Congratulations to our SIMPLAIX Principal Investigator Pascal Friederich (KIT) on the award of the Manfred Fuchs Prize 2025 for his outstanding research …
Save the date: Max Bonomi at the HITS-SIMPLAIX Colloquium
On 21 July 2025, Max Bonomi, Institut Pasteur, Paris (France) will give a joint HITS-SIMPLAIX Colloquium (hybrid) talk at the Studio Villa Bosch, …
Protein Dyamics & Machine Learning: Cecilia Clementi at the HITS-SIMPLAIX Colloquium
On 10 February 2025, Cecilia Clementi, Einstein Professor , Department of Physics, Freie Universität Berlin (Germany) gave a joint HITS-SIMPLAIX Colloquium on “Modeling …
Generative AI and the Physics of Molecules : Simon Olsson at the HITS-SIMPLAIX Colloquium
On 27 January 2025, Simon Olsson from the Chalmers University of Technology, Department for Computer Science and Engineering, Gothenburg (Sweden), gave a joint …
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