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@ReactionMechanismGenerator

Reaction Mechanism Generator

Developers of Reaction Mechanism Generator and associated software.

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  1. RMG-Py RMG-Py Public

    Python version of the amazing Reaction Mechanism Generator (RMG).

    Python 376 226

  2. ARC ARC Public

    ARC - Automatic Rate Calculator

    Python 42 21

  3. ReactionMechanismSimulator.jl ReactionMechanismSimulator.jl Public

    The amazing Reaction Mechanism Simulator for simulating large chemical kinetic mechanisms

    Jupyter Notebook 72 33

  4. AutoTST AutoTST Public

    AutoTST: A framework to perform automated transition state theory calculations

    Python 31 16

  5. T3 T3 Public

    The Tandem Tool (T3) for automated chemical kinetic model development

    Python 11 4

  6. pyrms pyrms Public

    Python wrapper for the ReactionMechanismSimulator

    Python 3 3

Repositories

Showing 10 of 26 repositories
  • RMG-database Public

    The database of chemical parameters used with Reaction Mechanism Generator

    ReactionMechanismGenerator/RMG-database’s past year of commit activity
    Python 94 136 84 44 Updated Jul 18, 2024
  • RMG-Py Public

    Python version of the amazing Reaction Mechanism Generator (RMG).

    ReactionMechanismGenerator/RMG-Py’s past year of commit activity
  • ARC Public

    ARC - Automatic Rate Calculator

    ReactionMechanismGenerator/ARC’s past year of commit activity
    Python 42 MIT 21 77 (13 issues need help) 28 Updated Jul 15, 2024
  • T3 Public

    The Tandem Tool (T3) for automated chemical kinetic model development

    ReactionMechanismGenerator/T3’s past year of commit activity
    Python 11 MIT 4 26 (2 issues need help) 17 Updated Jul 11, 2024
  • RMG-website Public

    A Django-powered website for Reaction Mechanism Generator (RMG)

    ReactionMechanismGenerator/RMG-website’s past year of commit activity
    Python 20 29 33 2 Updated Jul 9, 2024
  • ReactionMechanismSimulator.jl Public

    The amazing Reaction Mechanism Simulator for simulating large chemical kinetic mechanisms

    ReactionMechanismGenerator/ReactionMechanismSimulator.jl’s past year of commit activity
    Jupyter Notebook 72 MIT 33 45 (1 issue needs help) 9 Updated Jul 9, 2024
  • pyrms Public

    Python wrapper for the ReactionMechanismSimulator

    ReactionMechanismGenerator/pyrms’s past year of commit activity
    Python 3 MIT 3 0 2 Updated Jul 8, 2024
  • PyDAS Public

    A Python wrapper for the DASSL, DASPK, and DASKR differential algebraic system solvers

    ReactionMechanismGenerator/PyDAS’s past year of commit activity
    Fortran 7 6 0 0 Updated Jul 1, 2024
  • PyDQED Public

    A Python wrapper for the DQED constrained nonlinear optimization code

    ReactionMechanismGenerator/PyDQED’s past year of commit activity
    Fortran 1 MIT 4 0 0 Updated Jun 30, 2024
  • conda-recipes Public

    Anaconda conda build recipes for RMG dependencies

    ReactionMechanismGenerator/conda-recipes’s past year of commit activity
    Shell 0 4 0 0 Updated Jun 28, 2024