deepmd-kit
A deep learning package for many-body potential energy representation and molecular dynamics
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About
Summary
A deep learning package for many-body potential energy representation and molecular dynamics
Last Updated
Mar 19, 2026 at 16:01
License
LGPL-3.0-only
GitHub Repository
https://github.com/deepmodeling/deepmd-kitDocumentation
https://github.com/deepmodeling/deepmd-kit