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Achievement: YOLOAchievement: QuickdrawAchievement: Pull Sharkx2Achievement: Arctic Code Vault Contributor
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  1. cesmix-mit/PotentialLearning.jl cesmix-mit/PotentialLearning.jl Public

    An open source Julia library for active learning of interatomic potentials in atomistic simulations of materials. It incorporates elements of bayesian inference, machine learning, differentiable pr…

    Julia 18 9

  2. ActiveSubspaces.jl ActiveSubspaces.jl Public

    A Julia library for implementing active subspaces for QoI-based dimension reduction in stochastic systems characterized by an invariant measure.

    Julia

  3. cesmix-mit/Cairn.jl cesmix-mit/Cairn.jl Public

    Enhanced sampling algorithms for the active learning of machine learning interatomic potentials (ML-IPs), implemented in Julia.

    Julia 4

  4. cesmix-mit/AtomisticQoIs.jl cesmix-mit/AtomisticQoIs.jl Public

    Methods for computing expectation-valued quantities of interest (QoIs) from molecular dynamics simulation.

    Julia