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ml-peg v0.0.1
ml-peg v0.0.1

Contents:

  • User guide
    • Getting started
    • About ML-PEG
    • Benchmarks
      • Surfaces
      • NEBs
  • Developer guide
    • Getting started
    • Adding benchmarks
    • Adding categories
    • Adding new models
    • Running tests
  • API documentation
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Developer guide¶

  • Getting started
    • Dependency management
    • Using uv
    • Running unit tests
    • Automatic coding style check
    • Building the documentation
    • Continuous integration
  • Adding benchmarks
    • Identifying metrics
    • Running Calculations
    • Analysing Calculations
    • Build Dash components
  • Adding categories
  • Adding new models
  • Running tests
    • Calculations
    • Analysis
    • Application
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Getting started
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NEBs
Copyright © 2025, Elliott Kasoar, Joseph Hart, Ilyes Batatia, Alin M. Elena, Gábor Csányi. All rights reserved
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Last updated on Sep 29, 2025