Redesign Science

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1. AlphaSpace2 AlphaSpace2 Public

   Protein surface topographical mapping tool

   Jupyter Notebook 29 8

2. foldingathome_adaptive foldingathome_adaptive Public

   Scripts to run adaptive sampling on Folding@home

   Python 3

3. fep-benchmark-public fep-benchmark-public Public

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4. blues blues Public

   Forked from MobleyLab/blues

   Applications of nonequilibrium candidate Monte Carlo (NCMC) to ligand binding mode sampling

   Python

5. mdtrajx mdtrajx Public

   Forked from mdtraj/mdtraj

   MDtrajx is a forked version of MDtraj, includes additional functionality such as integrated parmed object.

   C

6. h5pyd h5pyd Public

   Forked from HDFGroup/h5pyd

   h5py distributed - Python client library for HDF Rest API

   Python