Showing 2 open source projects for "molecular visualization"

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    Molly.jl

    Molly.jl

    Molecular simulation in Julia

    Much of science can be explained by the movement and interaction of molecules. Molecular dynamics (MD) is a computational technique used to explore these phenomena, from noble gases to biological macromolecules. Molly.jl is a pure Julia package for MD, and for the simulation of physical systems more broadly. The package is described in a talk at Enzyme Conference 2023 and an earlier talk at the JuliaMolSim minisymposium at JuliaCon 2022. Slides are also available for a tutorial in September...
    Downloads: 8 This Week
    Last Update:
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  • 2
    MolecularGraph.jl

    MolecularGraph.jl

    Graph-based molecule modeling toolkit for cheminformatics

    MolecularGraph.jl is a graph-based molecule modeling and chemoinformatics analysis toolkit fully implemented in Julia.
    Downloads: 9 This Week
    Last Update:
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