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Helmut Grubmüller

Helmut Grubmüller

D-Index & Metrics

Chemistry

D-Index
91
Citations
37200
World Ranking
1945
National Ranking
143

Overview

Helmut Grubmüller is a researcher primarily affiliated with the Max Planck Society in Germany. Their work spans a significant range of topics in biochemistry, genetics, and molecular biology, with a particular focus on molecular biology as a central subfield. Other important subfields include atomic and molecular physics and optics, spectroscopy, cell biology, and materials chemistry.

Their research covers a variety of main topics, including:

  • Protein Structure and Dynamics
  • Spectroscopy and Quantum Chemical Studies
  • RNA and protein synthesis mechanisms
  • Advanced Electron Microscopy Techniques and Applications
  • Enzyme Structure and Function
  • Mass Spectrometry Techniques and Applications
  • Microtubule and mitosis dynamics

Helmut Grubmüller's recent notable papers include:

  • "A GPU-Accelerated Fast Multipole Method for GROMACS: Performance and Accuracy", 2020, Journal of Chemical Theory and Computation
  • "GROMACS in the Cloud: A Global Supercomputer to Speed Up Alchemical Drug Design", 2022, Journal of Chemical Information and Modeling
  • "Structural and mechanistic basis for translation inhibition by macrolide and ketolide antibiotics", 2021, Nature Communications
  • "Time-Lagged Independent Component Analysis of Random Walks and Protein Dynamics", 2021, Journal of Chemical Theory and Computation
  • "Structural conservation of antibiotic interaction with ribosomes", 2023, Nature Structural & Molecular Biology

Frequent co-authors collaborating with Helmut Grubmüller include:

  • Lars V. Bock
  • Gábor Nagy
  • Maxim Igaev
  • Carsten Kutzner
  • Sara M. Vaiana

In terms of publication venues, Helmut Grubmüller has contributed most extensively to the Biophysical Journal, with 49 publications. Other frequent venues include bioRxiv (Cold Spring Harbor Laboratory) with 20 publications, the Journal of Chemical Theory and Computation with 12 publications, arXiv (Cornell University) with 10 publications, and Nature Communications with 6 publications.

Best Publications

  • CHARMM36m: An improved force field for folded and intrinsically disordered proteins

    Jing Huang;Sarah Rauscher;Grzegorz Nawrocki;Ting Ran

  • Molecular Anatomy of a Trafficking Organelle

    Shigeo Takamori;Matthew Holt;Katinka Stenius;Edward A. Lemke

  • Water Permeation Across Biological Membranes: Mechanism and Dynamics of Aquaporin-1 and GlpF

    Bert L. de Groot;Helmut Grubmüller

  • Recognition Dynamics Up to Microseconds Revealed from an RDC-Derived Ubiquitin Ensemble in Solution

    Oliver F. Lange;Nils Alexander Lakomek;Christophe Farès;Gunnar F. Schröder

  • Ligand Binding: Molecular Mechanics Calculation of the Streptavidin-Biotin Rupture Force

    Helmut Grubmüller;Berthold Heymann;Paul Tavan

  • Generalized Verlet Algorithm for Efficient Molecular Dynamics Simulations with Long-range Interactions

    H. Grubmüller;H. Heller;A. Windemuth;K. Schulten

  • Predicting slow structural transitions in macromolecular systems: Conformational flooding.

    Helmut Grubmüller

  • Effect of Sodium Chloride on a Lipid Bilayer

    Rainer A. Böckmann;Agnieszka Hac;Thomas Heimburg;Helmut Grubmüller

  • Membrane protein sequestering by ionic protein–lipid interactions

    Geert van den Bogaart;Karsten Meyenberg;H. Jelger Risselada;Hayder Amin

  • Anatomy and dynamics of a supramolecular membrane protein cluster

    Jochen J. Sieber;Katrin I. Willig;Carsten Kutzner;Claas Gerding-Reimers

  • Generalized correlation for biomolecular dynamics.

    Oliver F. Lange;Helmut Grubmüller

  • Structural Ensembles of Intrinsically Disordered Proteins Depend Strongly on Force Field: A Comparison to Experiment

    Sarah Rauscher;Vytautas Gapsys;Michal J. Gajda;Markus Zweckstetter;Markus Zweckstetter;Markus Zweckstetter

  • Mechanoenzymatics of titin kinase

    Elias M. Puchner;Alexander Alexandrovich;Ay Lin Kho;Ulf Hensen

  • g_membed: Efficient insertion of a membrane protein into an equilibrated lipid bilayer with minimal perturbation.

    Maarten G. Wolf;Martin Hoefling;Camilo Aponte-Santamaría;Helmut Grubmüller

  • More bang for your buck: Improved use of GPU nodes for GROMACS 2018

    Carsten Kutzner;Szilárd Páll;Martin Fechner;Ansgar Esztermann

  • Structure and function of water channels

    Yoshinori Fujiyoshi;Yoshinori Fujiyoshi;Kaoru Mitsuoka;Bert L de Groot;Ansgar Philippsen

  • Interaction of urea with amino acids: Implications for urea-induced protein denaturation

    Martin C. Stumpe;Helmut Grubmüller

  • Kinetics, statistics, and energetics of lipid membrane electroporation studied by molecular dynamics simulations.

    Rainer A. Böckmann;Bert L. de Groot;Sergej Kakorin;Eberhard Neumann

  • The mechanism of proton exclusion in the aquaporin-1 water channel

    Bert L. de Groot;Tomaso Frigato;Volkhard Helms;Helmut Grubmüller

  • Single-molecule fluorescence resonance energy transfer reveals a dynamic equilibrium between closed and open conformations of syntaxin 1.

    M. Margittai;Jerker Widengren;E. Schweinberger;G. F. Schroder

Frequent Co-Authors

Bert L. de Groot
Bert L. de Groot Max Planck Society
Gerrit Groenhof
Gerrit Groenhof University of Jyväskylä
Reinhard Jahn
Reinhard Jahn Max Planck Society
Marina V. Rodnina
Marina V. Rodnina Max Planck Society
Stefan W. Hell
Stefan W. Hell Max Planck Society
Ralf Ficner
Ralf Ficner University of Göttingen
Holger Stark
Holger Stark Max Planck Society
Claus A.M. Seidel
Claus A.M. Seidel Heinrich Heine University Düsseldorf
Andreas Engel
Andreas Engel University of Basel
Daniel N. Wilson
Daniel N. Wilson Universität Hamburg

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