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1. Deep-VPS Deep-VPS Public

   Jupyter Notebook 4 1

2. openmm-nonconservative openmm-nonconservative Public

   Forked from openmm/openmm

   A modified version of OpenMM that allows declaration of Nonconservative CustomNonbondedForces in CUDA and OpenCL

   C++ 2 1

3. Rigid-Field Rigid-Field Public

   A CUDA-accelerated field theory engine for simulating rigid bodies in charged electrolytes.

   Python

4. OpenMM-Active-Systems OpenMM-Active-Systems Public

   Sample simulations of active systems in OpenMM

   Jupyter Notebook

5. TPS-U-OpenMM TPS-U-OpenMM Public

   Implementation of Transition Path Sampling + Umbrella Sampling in OpenMM for computing rates of isomerization of alanine dipeptide

   Python

6. Splitting-Optimal Splitting-Optimal Public

   Jupyter Notebook