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SBGridTV

Supported Applications

GROMACS

  • Description

    a versatile package that performs molecular dynamics of proteins, lipids and nucleic acids.

  • Primary Citation*

    S. Pronk, S. Páll, R. Schulz, P. Larsson, P. Bjelkmar, R. Apostolov, M. R. Shirts, J. C. Smith, P. M. Kasson, D. van der Spoel, B. Hess, and E. Lindahl. 2013. GROMACS 4.5: a high-throughput and highly parallel open source molecular simulation toolkit. Bioinformatics. 29(7): 845-854.

    • *Full citation information available through

  • Categories

    Computational Chemistry, Structural Biology

  • Default Versions

    Linux 64 5.1.2
    OS X INTEL 5.1.2

  • Other Available Versions

    Linux 32 3.3.1
    Linux 32 4.0.5
    Linux 32 4.5.5
    Linux 32 4.6
    Linux 64 5.1
    Linux 64 5.1.1
    Linux 64 5.1.4
    OS X INTEL 5.1
    OS X INTEL 5.1.1
    OS X INTEL 5.1.4
    OS X INTEL 5.1_gcc
    powermac 3.3
    powermac 4.0.5

  • Developers

    Berk Hess, Erik Lindahl, David Van der Spoel.