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Johannes Kästner

Researcher Next ID · RN-000342

Professor · Computer Science

University of Stuttgart

Stuttgart, Germany

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Not currently recruitingFunding unknown
Works count
539
Citation count
11,028
H-index
49
i10-index
180

About

539 publications and 11,023 citations recorded on OpenAlex.

Research interests

Computer Science
Crystallization and Solubility Studies
X-ray Diffraction in Crystallography
Advanced Chemical Physics Studies
Amyloidosis: Diagnosis, Treatment, Outcomes
Machine Learning in Materials Science

Publications

  • C hem S hell—a modular software package for QM / MM simulations

    Wiley Interdisciplinary Reviews Computational Molecular Science · 2013 · 10.1002/wcms.1163

  • Umbrella sampling

    Wiley Interdisciplinary Reviews Computational Molecular Science · 2011 · 10.1002/wcms.66

  • DL-FIND: An Open-Source Geometry Optimizer for Atomistic Simulations

    The Journal of Physical Chemistry A · 2009 · 10.1021/jp9028968

  • Superlinearly converging dimer method for transition state search

    The Journal of Chemical Physics · 2008 · 10.1063/1.2815812

  • Bridging the gap between thermodynamic integration and umbrella sampling provides a novel analysis method: “Umbrella integration”

    The Journal of Chemical Physics · 2005 · 10.1063/1.2052648

Current projects

    No projects listed.