MatterTune

Getting Started

  • Introduction
  • Motivation
  • Installation Guide

User Guide

  • Datasets
  • Fine-Tuning a Pre-trained Model
  • Model Usage Guide
  • Training Configuration Guide
  • Normalization
  • Advanced: Lightning Integration

Model Backbones

  • JMP Backbone
  • M3GNet Backbone
  • ORB Backbone
  • EquiformerV2 Backbone
  • MatterSim Backbone

Development

  • API Reference
    • mattertune.backbones
    • mattertune.callbacks
    • mattertune.configs
    • mattertune.data
      • mattertune.data.atoms_list
      • mattertune.data.base
      • mattertune.data.datamodule
      • mattertune.data.db
      • mattertune.data.json_data
      • mattertune.data.matbench
      • mattertune.data.mp
      • mattertune.data.mptraj
      • mattertune.data.omat24
      • mattertune.data.xyz
    • mattertune.finetune
    • mattertune.loggers
    • mattertune.main
    • mattertune.normalization
    • mattertune.registry
    • mattertune.wrappers
  • Contributing to MatterTune
  • License Information
MatterTune
  • API Reference
  • mattertune.data
  • View page source

mattertune.data

Modules

atoms_list

base

datamodule

db

json_data

matbench

mp

mptraj

omat24

xyz

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