deepmd-kit

Repository facts

Stars

2,061

Forks

660

Open issues and pull requests

240

Primary language

Python

License

GNU Lesser General Public License v3.0 (LGPL-3.0)

Owner

deepmodeling · Organization

Created

Dec 12, 2017

Last push

Oct 18, 2026

Topics

• ase
• c
• computational-chemistry
• cpp
• cuda
• deep-learning
• deepmd
• ipi
• jax
• lammps
• machine-learning-potential
• materials-science
• molecular-dynamics
• nodejs
• paddle
• potential-energy
• python
• pytorch
• rocm
• tensorflow

Rank #3,574 of 9,507 in AI on GitHub, by stars. Data from the GitHub API, fetched Oct 18, 2026; star counts change daily. Stars measure popularity, not quality or safety, and a listing is not an endorsement. How this list is made

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