• Home
  • Blog
  • Tutorials
  • Docs
    DeePMD-kit

    DP-GEN

    dpdata

    DPDispatcher

    ABACUS

    DeepFlame

    DPTI

  • Publications
  • GitHub
  • Home
  • Blog
  • Tutorials
  • Docs
  • Publications
  • GitHub
DeePMD-kit Logo
v2.2.11

Getting Started

  • Getting Started

Advanced

  • 1. Installation
    • 1.1. Easy install
    • 1.2. Install from source code
    • 1.3. Install from pre-compiled C library
    • 1.4. Install LAMMPS
    • 1.5. Install i-PI
    • 1.6. Install GROMACS with DeepMD
    • 1.7. Building conda packages
    • 1.8. Install Node.js interface
    • 1.9. Easy install the latest development version
  • 2. Data
  • 3. Model
  • 4. Training
  • 5. Freeze and Compress
  • 6. Test
  • 7. Inference
  • 8. Command line interface
  • 9. Integrate with third-party packages
  • 10. Use NVNMD
  • 11. FAQs

Tutorial

  • Tutorials
  • Publications

Developer Guide

  • Find DeePMD-kit C/C++ library from CMake
  • Create a model
  • Atom Type Embedding
  • Coding Conventions
  • CI/CD
  • Python API
  • OP API
  • C++ API
  • C API
  • Core API

Project Details

  • License
  • Authors and Credits
  • Logo
DeePMD-kit
  • 1. Installation
  • Edit on GitHub

1. Installation

  • 1.1. Easy install
  • 1.2. Install from source code
  • 1.3. Install from pre-compiled C library
  • 1.4. Install LAMMPS
  • 1.5. Install i-PI
  • 1.6. Install GROMACS with DeepMD
  • 1.7. Building conda packages
  • 1.8. Install Node.js interface
  • 1.9. Easy install the latest development version
PreviousNext

© Copyright 2017-2024, DeepModeling. Revision 84ca63ca.

Built with Sphinx using a theme provided by Read the Docs.

京ICP备20010051号-8