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lab-cosmo/librascal
lab-cosmo/librascal PublicA scalable and versatile library to generate representations for atomic-scale learning
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libAtoms/QUIP
libAtoms/QUIP PubliclibAtoms/QUIP molecular dynamics framework: https://libatoms.github.io
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wessa-delay
wessa-delay PublicImplementation of the stochastic simulation algorithm (SSA) with weighted-ensemble resampling
Jupyter Notebook 1
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lammps/lammps
lammps/lammps PublicPublic development project of the LAMMPS MD software package
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