1.9. Easy install the latest development version
DeePMD-kit is actively developed in the devel branch. The documentation of the latest version matches the devel branch.
The following is the way to install the pre-compiled packages without building from source. All of them are built with GitHub Actions. The For CUDA 11.8 support, use the Below is an one-line shell command to download the artifact containing wheels and install it with The pre-comiled C library can be downloaded from here, or via a shell command: Pre-release conda-forge packages are in 1.9.1. Install with docker
devel tag is used to mark the latest development version with CUDA 12.2 support:docker pull ghcr.io/deepmodeling/deepmd-kit:devel
devel_cu11 tag.1.9.2. Install with pip
pip:pip install -U --pre deepmd-kit[gpu,cu12,lmp] --extra-index-url https://deepmodeling.github.io/deepmd-kit/simple
cu12 and lmp are optional, which is the same as the stable version.1.9.3. Download pre-compiled C Library
wget https://nightly.link/deepmodeling/deepmd-kit/workflows/package_c/devel/libdeepmd_c-0-libdeepmd_c.tar.gz.zip && unzip libdeepmd_c-0-libdeepmd_c.tar.gz.zip
1.9.4. Pre-release conda-forge packages
conda-forge/label/deepmd-kit_dev or conda-forge/label/deepmd-kit_rc channels, other than the conda-forge channel. See conda-forge documentation for more information.