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Merge pull request #1972 from glotzerlab/fix-gpu-install
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Note the current conda-forge CUDA version.
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joaander authored Dec 18, 2024
2 parents 58b7ba5 + 521c2c2 commit bacaac1
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2 changes: 2 additions & 0 deletions CHANGELOG.rst
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Expand Up @@ -11,6 +11,8 @@ Change Log

* Prevent ``missing 1 required positional argument: 'kT'`` errors when using NEC integrators
(`#1965 <https://github.com/glotzerlab/hoomd-blue/pull/1965>`__)
* Note the current version of CUDA in the micromamba installation instructions
(`#1972 <https://github.com/glotzerlab/hoomd-blue/pull/1972>`__)


5.0.0 (2024-12-02)
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14 changes: 7 additions & 7 deletions INSTALLING.rst
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Expand Up @@ -31,8 +31,13 @@ appropriate package. Override this and force the GPU enabled package installatio

.. code-block:: bash
export CONDA_OVERRIDE_CUDA="12.0"
micromamba install "hoomd=5.0.0=*gpu*" "cuda-version=12.0"
export CONDA_OVERRIDE_CUDA="12.6"
micromamba install "hoomd=5.0.0=*gpu*" "cuda-version=12.6"
.. note::

conda-forge_ may update to a new version of CUDA. If the above command results in an error,
replace ``12.6`` with the version noted in micromamba's error message.

Similarly, you can force CPU-only package installation with:

Expand All @@ -44,8 +49,3 @@ Similarly, you can force CPU-only package installation with:

CUDA 11.8 compatible packages are also available. Replace "12.0" with "11.8" above when
installing HOOMD-blue on systems with CUDA 11 compatible drivers.

.. note::

Run time compilation is no longer available on conda-forge builds starting with HOOMD-blue
4.7.0.

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