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  1. sim_eval sim_eval Public

    A (tiny) wrapper around ASE calculators to speed up analyzing and comparing the accuracy of different molecular dynamics simulation methods.

    Python

  2. DiffusionAnalysis DiffusionAnalysis Public

    A python package to analyse diffusive properties of an MD simulation.

    Python 3 1

  3. ArduinoAD8232ECG ArduinoAD8232ECG Public

    An open source arduino heart rate monitor based on the AD8232 with a graphical interface written in python.

    Python 13 8

  4. CompSimCW CompSimCW Public

    Python

  5. thunderlamp thunderlamp Public

    A simple Arduino controlled LED lamp. Led's dispersed throughout the model can flash to simulate lightning

    C++

  6. Rewrite of the ase LAMMPS dat file p... Rewrite of the ase LAMMPS dat file parser to yield 50-100x speedup and properly implement lazy loading and indexing
    1
    # All rights for ase belong to the owners at https://gitlab.com/ase/ase
    2
    # this is a partial rewrite of the original lammpsrun.py found at:
    3
    # https://gitlab.com/ase/ase/-/blob/master/ase/io/lammpsrun.py?ref_type=heads
    4
    # Modifcations made by Chris Davies. See ase merge request 
    5
    # https://gitlab.com/ase/ase/-/merge_requests/3354