deepmd-kit
A deep learning package for many-body potential energy representation and molecular dynamics
Installation
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About
Summary
A deep learning package for many-body potential energy representation and molecular dynamics
Last Updated
Aug 20, 2026 at 09:12
License
LGPL-3.0-only
Supported Platforms
linux-64
macOS-arm64
Unsupported Platforms
macOS-64 Last supported version: 3.1.3
linux-aarch64 Last supported version: 3.1.3
GitHub Repository
https://github.com/deepmodeling/deepmd-kitDocumentation
https://github.com/deepmodeling/deepmd-kit