The Wayback Machine - https://web.archive.org/web/20230630133353/http://github.com/VlachosGroup
Skip to content
@VlachosGroup

VlachosGroup

Dion Vlachos research group

Pinned

  1. pMuTT Public

    Python Multiscale Thermochemistry Toolbox (pMuTT)

    Python 31 17

  2. Kinetic Monte Carlo with multiple time scales and sensitivity analysis

    C++ 20 7

  3. First-Principles Semi-Empirical (FPSE) Group Additivity (GA) method for estimating thermodynamic properties of molecules

    Python 8 8

  4. renview Public

    The Reaction Network Viewer (ReNView) generates a graphic representation of the reaction fluxes within the system essential for identifying dominant reaction pathways and mechanism reduction.

    Python 18 11

  5. lcnn Public

    Lattice Convolutional Neural Network (LCNN)

    Python 10 1

Repositories