Standout Papers

GROMACS: High performance molecular... 1997 2026 2006 2016 16.7k
  1. GROMACS: High performance molecular simulations through multi-level parallelism from laptops to supercomputers (2015)
    M Abraham, Teemu J. Murtola et al. SoftwareX
  2. GROMACS: Fast, flexible, and free (2005)
    David van der Spoel, Erik Lindahl et al. Journal of Computational Chemistry
  3. LINCS: A linear constraint solver for molecular simulations (1997)
    Berk Hess, Henk Bekker et al. Journal of Computational Chemistry
  4. GROMACS 4:  Algorithms for Highly Efficient, Load-Balanced, and Scalable Molecular Simulation (2008)
    Berk Hess, Carsten Kutzner et al. Journal of Chemical Theory and Computation
  5. GROMACS 3.0: a package for molecular simulation and trajectory analysis (2001)
    Erik Lindahl, Berk Hess et al. Journal of Molecular Modeling
  6. GROMACS 4.5: a high-throughput and highly parallel open source molecular simulation toolkit (2013)
    Sander Pronk, Szilárd Páll et al. Bioinformatics
  7. P-LINCS:  A Parallel Linear Constraint Solver for Molecular Simulation (2007)
    Berk Hess Journal of Chemical Theory and Computation
  8. Implementation of the CHARMM Force Field in GROMACS: Analysis of Protein Stability Effects from Correction Maps, Virtual Interaction Sites, and Water Models (2010)
    Pär Bjelkmar, Per Larsson et al. Journal of Chemical Theory and Computation
  9. Improving efficiency of large time-scale molecular dynamics simulations of hydrogen-rich systems (1999)
    K. Anton Feenstra, Berk Hess et al. Journal of Computational Chemistry
  10. Determining the shear viscosity of model liquids from molecular dynamics simulations (2002)
    Berk Hess The Journal of Chemical Physics
  11. LINCS: A linear constraint solver for molecular simulations (1997)
    Berk Hess, Henk Bekker et al. Journal of Computational Chemistry
  12. A flexible algorithm for calculating pair interactions on SIMD architectures (2013)
    Szilárd Páll, Berk Hess Computer Physics Communications

Immediate Impact

9 by Nobel laureates 34 from Science/Nature 122 standout
Sub-graph 1 of 19

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Works of Berk Hess being referenced

GROMACS: High performance molecular simulations through multi-level parallelism from laptops to supercomputers
2015 Standout

Author Peers

Author Last Decade Papers Cites
Berk Hess 11334 43945 6100 14625 117 80.7k
Erik Lindahl 8932 39790 4611 11671 185 69.0k
David van der Spoel 10236 31219 5376 12061 162 60.0k
Herman J. C. Berendsen 23080 59262 10085 23566 161 110.3k
Wilfred F. van Gunsteren 16231 39801 8059 17823 528 68.8k
Tom Darden 7982 33167 4240 9509 48 54.3k
David A. Case 10509 51383 8256 14604 332 79.2k
Lee G. Pedersen 7742 28653 4088 8517 222 49.3k
Alexander D. MacKerell 10636 38159 5347 8956 468 56.1k
Jayaraman Chandrasekhar 11745 21558 5529 9075 178 46.3k
Klaus Schulten 21018 62362 7819 22827 510 115.8k

All Works

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