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Achievements

Achievement: Pull Sharkx4Achievement: Pair Extraordinairex3Achievement: YOLOAchievement: QuickdrawAchievement: StarstruckAchievement: Arctic Code Vault Contributor

Achievements

Achievement: Pull Sharkx4Achievement: Pair Extraordinairex3Achievement: YOLOAchievement: QuickdrawAchievement: StarstruckAchievement: Arctic Code Vault Contributor

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@zincware @SPP2363 @IPSProjects

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PythonFZ/README.md

Hi, I'm Fabian 👋

I'm a Ph.D student at the Institute of Computational Physics | University of Stuttgart working in the field of Machine Learning, primarily on Neural Network Potentials for molecular dynamics simulations.

Your Repository's Stats

🔭 As a core member of zincware, I'm mostly developing Software for the scientific community. Some of the projects I'm currently working on are

  • ZnTrack - Create, visualize, run & benchmark DVC pipelines in Python & Jupyter notebooks.
  • MDSuite - A post-processing engine for particle simulations.
  • ZnDraw - Visualize and Edit Molecular Structures.
  • ZnH5MD - High Performance Interface for H5MD Trajectories.
  • ZnFlow - General Purpose Framework for Computational Graphs.
  • ZnJSON - Package to Encode/Decode some common file formats to json.

Pinned Loading

  1. zincware/ZnTrack zincware/ZnTrack Public

    Create, visualize, run & benchmark DVC pipelines in Python & Jupyter notebooks.

    Python 49 5

  2. zincware/IPSuite zincware/IPSuite Public

    Machine Learned Interatomic Potential Tools

    Python 19 11

  3. zincware/ZnDraw zincware/ZnDraw Public

    Display and Edit Molecules (https://zndraw.icp.uni-stuttgart.de)

    TypeScript 37 4

  4. zincware/MDSuite zincware/MDSuite Public

    A post-processing engine for particle simulations

    Python 38 8

  5. zincware/ZnFlow zincware/ZnFlow Public

    A general purpose framework for building and running computational graphs.

    Python 6

  6. zincware/ZnH5MD zincware/ZnH5MD Public

    ZnH5MD - High Performance Interface for H5MD Trajectories

    Python 8