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| author | Weijia Wang <9713184+wegank@users.noreply.github.com> | 2024-05-22 14:48:43 +0200 |
|---|---|---|
| committer | GitHub <noreply@github.com> | 2024-05-22 14:48:43 +0200 |
| commit | 4e0a31f582db5f78fa8c56fc43596467dcd6b9f3 (patch) | |
| tree | f382b99431440684d62fa88edf681a104f2d6f0f /pkgs/development | |
| parent | 829298ee2c9dc3ea3ca46a6a9f835960f5f70cae (diff) | |
| parent | d2797c47910903d0772d51466f531c58409b6be2 (diff) | |
Merge pull request #313630 from natsukium/openmm/fix
python311Packages.openmm: fix installPhase
Diffstat (limited to 'pkgs/development')
| -rw-r--r-- | pkgs/development/libraries/science/chemistry/openmm/default.nix | 9 |
1 files changed, 6 insertions, 3 deletions
diff --git a/pkgs/development/libraries/science/chemistry/openmm/default.nix b/pkgs/development/libraries/science/chemistry/openmm/default.nix index d146fa073dc34..723ced8b2a590 100644 --- a/pkgs/development/libraries/science/chemistry/openmm/default.nix +++ b/pkgs/development/libraries/science/chemistry/openmm/default.nix @@ -42,6 +42,10 @@ stdenv.mkDerivation rec { swig doxygen python3Packages.python + ] ++ lib.optionals enablePython [ + python3Packages.build + python3Packages.installer + python3Packages.wheel ] ++ lib.optional enableCuda addOpenGLRunpath; buildInputs = [ fftwSinglePrec ] @@ -84,9 +88,8 @@ stdenv.mkDerivation rec { export OPENMM_LIB_PATH=$out/lib export OPENMM_INCLUDE_PATH=$out/include cd python - ${python3Packages.python.pythonOnBuildForHost.interpreter} setup.py build - ${python3Packages.python.pythonOnBuildForHost.interpreter} setup.py install --prefix=$out - mv $out/lib/python*/site-packages/OpenMM*.egg/{openmm,simtk} $out/lib/python*/site-packages/. + ${python3Packages.python.pythonOnBuildForHost.interpreter} -m build --no-isolation --outdir dist/ --wheel + ${python3Packages.python.pythonOnBuildForHost.interpreter} -m installer --prefix $out dist/*.whl ''; postFixup = '' |