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FlashCart 0.1.0
FlashCart FlashCart
0.1.0

Getting started

  • Installation
  • Quickstart

User guide

  • Configuration files
  • ASE calculator
  • LAMMPS interface

Tutorials

  • Data preparation
  • Training configurations
  • Molecular dynamics
  • Inference and training times

Advanced usage

  • Multi-GPU training
  • Performance and profiling

Reference

  • API reference
    • flashcart.model
    • flashcart.calculators
    • flashcart.o3
    • flashcart.nn
    • flashcart.data
    • flashcart.training
    • flashcart.cli
    • flashcart.utils
  • Environment variables
  • Publications
  • Citing FlashCart
  • Changelog
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