Skip to content
Avatar

Highlights

  • Arctic Code Vault Contributor

Popular repositories

  1. An example 2-node cluster with a slurm controller for running gromacs

    Shell 11 3

  2. Protein-ligand docking code autodock vina from vina.scripps.edu

    C++ 3 2

  3. Python scrapper for paramche/cgenff server, small molecule parametrization

    Python 2 2

  4. Manage MD simulations across multiple computing clusters

    Python 1 1

  5. Read plumed2 http://www.plumed.org COLVAR files as pandas DataFrames https://pandas.pydata.org

    Python 1

  6. A philistine-level simple example of Morgan fingerprint convoluted DNN on a DUDE target, the ACE protein

    Python 1 1

107 contributions in the last year

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

Contribution activity

September 2020

Created a pull request in Peergos/Peergos that received 1 comment

Document installation on macOS

A mini PR that documented my Peergos installation on my macOS. Should help any contributors getting onboard

+12 −1 1 comment

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

You can’t perform that action at this time.