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Achievements

Achievement: Pull Sharkx3Achievement: QuickdrawAchievement: YOLOAchievement: Pair ExtraordinaireAchievement: StarstruckAchievement: Arctic Code Vault Contributor

Achievements

Achievement: Pull Sharkx3Achievement: QuickdrawAchievement: YOLOAchievement: Pair ExtraordinaireAchievement: StarstruckAchievement: Arctic Code Vault Contributor

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@SSAGESLabs @Martini-Force-Field-Initiative @alessandri-group

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  1. Martini-Force-Field-Initiative/M3-Small-Molecules Martini-Force-Field-Initiative/M3-Small-Molecules Public

    Martini 3 small molecule database

    Shell 64 11

  2. marrink-lab/polyply_1.0 marrink-lab/polyply_1.0 Public

    Generate input parameters and coordinates for atomistic and coarse-grained simulations of polymers, ssDNA, and carbohydrates

    Python 166 28

  3. redox-active-polymers redox-active-polymers Public

    Multiscale models of redox-active, radical-containing polymers for all organic batteries

    Python 2

  4. ECG-RedoxPoly-Cathode ECG-RedoxPoly-Cathode Public

    Data and code associated with https://arxiv.org/abs/2209.02072 / https://doi.org/10.1021/acs.macromol.3c00141

    Shell 2

  5. Martini3-mappings Martini3-mappings Public

    Mapping small-molecules to Martini 3 coarse-grained representations

    4

  6. SSAGESLabs/PySAGES SSAGESLabs/PySAGES Public

    Python Suite for Advanced General Ensemble Simulations

    Python 92 29