Skip to content


  • Arctic Code Vault Contributor


  1. The Open Forcefield Toolkit provides implementations of the SMIRNOFF format, parameterization engine, and other tools. Documentation available at

    Jupyter Notebook 119 38

  2. Handy functionality for working with OpenFF data

    Python 2 2

  3. A multicore python implementation of a Boltzmann-weighted principal curve

    Python 1

  4. Forked from swflynn/Quasi_Regular_Grids

    Numerical Grid Generation Through Quasi-Lennard-Jones Potential


  5. Research-grade tool to study performance of threaded, GPU accelerated rigid rotation of 3D coordinates


  6. A collection of tools in bash to facilitate work using the AMBER molecular dynamics simulation package


402 contributions in the last year

Dec Jan Feb Mar Apr May Jun Jul Aug Sep Oct Nov Mon Wed Fri

Contribution activity

Seeing something unexpected? Take a look at the GitHub profile guide.

You can’t perform that action at this time.