Researcher

Klaus-Robert Müller

Klaus-Robert Müller is a machine-learning researcher whose work includes support-vector machines, explainable AI, and machine learning for scientific discovery. He earned degrees in mathematical physics and theoretical computer science in Karlsruhe, built the Intelligent Data Analysis group in Berlin, and became a professor at Potsdam and TU Berlin. As of October 2026, he is Professor of Machine Learning at TU Berlin and Director of BIFOLD. He received the 2024 Feynman Prize in Theory, the 2026 Gottfried Wilhelm Leibniz Prize, and the 2026 IEEE Neural Network Pioneer Award.

Works
706
Citations
78,816
h-index
111

Publication numbers from OpenAlex, as of 14 October 2026.

Photo of Klaus-Robert Müller

Timeline

  1. 1989–1995

    Physics and computer science

    He earns a diploma in mathematical physics at the University of Karlsruhe in 1989 and a PhD in theoretical computer science there in 1992. He works as a postdoctoral fellow at GMD FIRST in Berlin from 1992 to 1994 and joins the University of Tokyo as a European Community STP research fellow in 1994–1995.

  2. 1990s–2008

    Support-vector machines and IDA

    In the 1990s, he and Vladimir Vapnik develop theoretical foundations for support-vector machines. He leads the Intelligent Data Analysis group at GMD FIRST from 1995 to 2008 and holds a joint associate professorship with GMD and the University of Potsdam from 1999. He becomes a full professor at Potsdam in 2003 and chairs machine learning at TU Berlin from 2006.

  3. 2010–2017

    Explainable AI and quantum chemistry

    Since 2010, he develops explainable AI methods that make machine-learning processes transparent. During a 2011 sabbatical at the Institute for Pure and Applied Mathematics at the University of California, Los Angeles, he develops the idea of using machine learning to predict outcomes of the Schrödinger equation. He becomes a member of the German National Academy of Sciences Leopoldina in 2012 and joins the Berlin-Brandenburg Academy of Sciences in 2017.

  4. Since 2022

    Co-leading BIFOLD

    He and Volker Markl co-lead BIFOLD from July 2022. The institute conducts fundamental research in machine learning, data management, and their interfaces.

  5. 2024

    A Feynman Prize in Theory

    Foresight Institute awards him the 2024 Feynman Prize in Theory.

  6. 2026

    A Leibniz Prize

    On March 18, 2026, the German Research Foundation awards him the Gottfried Wilhelm Leibniz Prize for foundational contributions to AI and its applications in the natural sciences.

  7. 2026

    An IEEE Pioneer Award

    The IEEE Computational Intelligence Society awards him the 2026 Neural Network Pioneer Award for contributions to kernel-based learning.

  8. As of October 2026

    Professor and BIFOLD director

    He is Professor of Machine Learning at TU Berlin and Director of BIFOLD. His team develops SO3LR, a foundation model for quantum chemistry, and Atlas-2, a foundation model for histopathology. His research uses machine learning and explainable AI to help scientists uncover patterns and formulate new research questions.

Sources and credits

Photo: Tatjana Ruf, via Wikimedia Commons. License: CC BY-SA 2.0. Source: commons.wikimedia.org. Cropped to a square and resized. Ask us to remove or replace this photo.

  1. Prof. Dr. Klaus-Robert Müller | Machine Learning Group ml.tu-berlin.de. Checked 14 October 2026.
  2. Gottfried Wilhelm Leibniz Prize awarded to Klaus-Robert Müller bifold.berlin. Checked 14 October 2026.
  3. Prize Awarded for Achievements in Nanotechnology tu.berlin. Checked 14 October 2026.
  4. Klaus-Robert Müller honored with the Leibniz Prize bifold.berlin. Checked 14 October 2026.
  5. Pioneer Award for Klaus-Robert Müller bifold.berlin. Checked 14 October 2026.
  6. New Video Portrait: AI in Science: How AI Is Changing the Questions We Ask – Klaus-Robert Müller nachrichten.idw-online.de. Checked 14 October 2026.