Standout Papers

CHARMM36m: an improved force field fo... 2001 2026 2009 2017 4.2k
  1. CHARMM36m: an improved force field for folded and intrinsically disordered proteins (2016)
    Jing Huang, Sarah Rauscher et al. Nature Methods
  2. Ligand docking and binding site analysis with PyMOL and Autodock/Vina (2010)
    Daniel Seeliger, Bert L. de Groot Journal of Computer-Aided Molecular Design
  3. g_wham—A Free Weighted Histogram Analysis Implementation Including Robust Error and Autocorrelation Estimates (2010)
    Jochen S. Hub, Bert L. de Groot et al. Journal of Chemical Theory and Computation
  4. Recognition Dynamics Up to Microseconds Revealed from an RDC-Derived Ubiquitin Ensemble in Solution (2008)
    Oliver F. Lange, Nils‐Alexander Lakomek et al. Science
  5. Water Permeation Across Biological Membranes: Mechanism and Dynamics of Aquaporin-1 and GlpF (2001)
    Bert L. de Groot, Helmut Grubmüller Science
  6. More bang for your buck: Improved use of GPU nodes for GROMACS 2018 (2019)
    Carsten Kutzner, Szilárd Páll et al. Journal of Computational Chemistry

Immediate Impact

34 by Nobel laureates 40 from Science/Nature 93 standout
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Citing Papers

Enhancing ion selectivity by tuning solvation abilities of covalent-organic-framework membranes
2024 Standout
Structural basis of NINJ1-mediated plasma membrane rupture in cell death
2023 StandoutNature
23 intermediate papers

Works of Bert L. de Groot being referenced

CHARMM36m: an improved force field for folded and intrinsically disordered proteins
2016 Standout
An Atomistic View of Amyloidogenic Self-assembly: Structure and Dynamics of Heterogeneous Conformational States in the Pre-nucleation Phase
2016
and 20 more

Author Peers

Author Last Decade Papers Cites
Bert L. de Groot 15175 3336 1993 2352 225 20.5k
Wonpil Im 19541 2587 3057 2510 309 26.2k
Michael Feig 16184 4293 2863 1288 172 20.7k
James C. Gumbart 13793 3110 2400 2103 154 20.0k
Helmut Grubmüller 15775 3384 4376 2258 256 22.1k
Christophe Chipot 15792 4297 4439 2652 238 23.9k
Kim A. Sharp 15536 4226 3804 1920 146 22.4k
Robert D. Skeel 11948 3169 2790 2117 96 19.8k
Laxmikant V. Kalé 10809 2827 2118 1884 109 17.2k
Huan‐Xiang Zhou 14112 4575 2138 1207 397 18.4k
Emad Tajkhorshid 20404 4002 3866 4084 350 30.6k

All Works

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2026