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1. curator curator Public

   A flexible workflow for on-the-fly learning of interatomic potential models.

   Python 24 1

2. painn-sli painn-sli Public

   This is the source code for paper "Neural Network Potentials for Accelerated Metadynamics of Oxygen Reduction Kinetics at Au-Water Interfaces"

   Python 21 3

3. dtu-energy/curator dtu-energy/curator Public

   Building Robust Machine Learning Potentials for Atomistic Simulations

   Python 4 1

4. myqueue myqueue Public

   Python