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DeepMD-kit: conda installation
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deepmd-conda-installation.md

2.2.8

CONDA_OVERRIDE_CUDA="11.8" conda create -p deepmd/2.2.8/gpu deepmd-kit=2.2.8=cuda118py310*  lammps horovod -c conda-forge

To work around a known issue of conda-forge's tensorflow package, one has to run pip install nvidia-cuda-nvcc-cu11 in the conda environment.

Before 2.2.8

CONDA_OVERRIDE_CUDA="11.6" conda create -n deepmd deepmd-kit=2.2.7=*gpu libdeepmd=2.2.7=*gpu lammps cudatoolkit=11.6 horovod -c https://conda.deepmodeling.com -c defaults
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