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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 397 228

  2. ARC ARC Public

    ARC - Automatic Rate Calculator

    Python 43 22

  3. ReactionMechanismSimulator.jl ReactionMechanismSimulator.jl Public

    The amazing Reaction Mechanism Simulator for simulating large chemical kinetic mechanisms

    Jupyter Notebook 75 32

  4. AutoTST AutoTST Public

    AutoTST: A framework to perform automated transition state theory calculations

    Python 33 16

  5. T3 T3 Public

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

    Python 12 5

  6. pyrms pyrms Public

    Python wrapper for the ReactionMechanismSimulator

    Python 3 4

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 96 139 85 42 Updated Nov 22, 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 43 MIT 22 78 (13 issues need help) 29 Updated Nov 21, 2024
  • T3 Public

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

    ReactionMechanismGenerator/T3’s past year of commit activity
    Python 12 MIT 5 27 (2 issues need help) 15 Updated Nov 17, 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 75 MIT 32 46 (1 issue needs help) 11 Updated Nov 8, 2024
  • RMG-website Public

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

    ReactionMechanismGenerator/RMG-website’s past year of commit activity
    Python 21 29 36 1 Updated Aug 14, 2024
  • AutoTST Public

    AutoTST: A framework to perform automated transition state theory calculations

    ReactionMechanismGenerator/AutoTST’s past year of commit activity
    Python 33 16 22 1 Updated Aug 13, 2024
  • ReactionMechanismGenerator.github.io Public

    Legacy Redirect Page for RMG-Py Documentation

    ReactionMechanismGenerator/ReactionMechanismGenerator.github.io’s past year of commit activity
    HTML 0 MIT 0 0 0 Updated Aug 6, 2024
  • pyrms Public

    Python wrapper for the ReactionMechanismSimulator

    ReactionMechanismGenerator/pyrms’s past year of commit activity
    Python 3 MIT 4 0 1 Updated Aug 4, 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