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1. OpenDUck OpenDUck Public

   Early implementation of OpenDUck

   Python 1

2. torchmd-cg-1 torchmd-cg-1 Public

   Forked from torchmd/torchmd-cg

   Codebase to fit parameters, train and build coarse-grained simulations using torchMD

   Jupyter Notebook 1

3. DUck DUck Public

   Forked from CBDD/DUck

   Dynamic Undocking

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4. torchmd-net torchmd-net Public

   Forked from torchmd/torchmd-net-legacy

   TorchMD-NET. This is a simple code to train Schnet using pytorch-lighthing.

   Python

5. biotrainer biotrainer Public

   Forked from sacdallago/biotrainer

   fork of biotrainer for my custom features

   Python