e4s ci stacks: add python packages (#42774)
* e4s ci stacks: add python packages * comment out failing specs
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		| @@ -182,6 +182,25 @@ spack: | ||||
|   # - libpressio +bitgrooming +bzip2 ~cuda ~cusz +fpzip +hdf5 +libdistributed +lua +openmp +python +sz +sz3 +unix +zfp # py-numcodecs@0.7.3: gcc: error: unrecognized command-line option '-mno-sse2' | ||||
|   # - variorum                      # variorum: https://github.com/spack/spack/issues/38786 | ||||
|  | ||||
|   # PYTHON PACKAGES | ||||
|   - opencv +python3 | ||||
|   - py-horovod | ||||
|   - py-jax | ||||
|   - py-jupyterlab | ||||
|   - py-matplotlib | ||||
|   - py-notebook | ||||
|   - py-numpy | ||||
|   - py-openai | ||||
|   - py-pandas | ||||
|   - py-plotly | ||||
|   - py-pooch | ||||
|   - py-pytest | ||||
|   - py-scikit-learn | ||||
|   - py-scipy | ||||
|   - py-seaborn | ||||
|   - py-tensorflow | ||||
|   - py-torch | ||||
|  | ||||
|   # CUDA NOARCH | ||||
|   - flux-core +cuda | ||||
|   - hpctoolkit +cuda | ||||
|   | ||||
| @@ -281,6 +281,25 @@ spack: | ||||
|   # - slepc +cuda cuda_arch=80      # slepc: make[1]: *** internal error: invalid --jobserver-auth string 'fifo:/tmp/GMfifo1313'. | ||||
|   # - upcxx +cuda cuda_arch=80      # upcxx: needs NVIDIA driver | ||||
|  | ||||
|   # PYTHON PACKAGES | ||||
|   - opencv +python3 | ||||
|   - py-horovod | ||||
|   - py-jax | ||||
|   - py-jupyterlab | ||||
|   - py-matplotlib | ||||
|   - py-notebook | ||||
|   - py-numpy | ||||
|   - py-openai | ||||
|   - py-pandas | ||||
|   - py-plotly | ||||
|   - py-pooch | ||||
|   - py-pytest | ||||
|   - py-scikit-learn | ||||
|   - py-scipy | ||||
|   - py-seaborn | ||||
|   - py-tensorflow | ||||
|   - py-torch | ||||
|  | ||||
|   # CUDA 90 | ||||
|   - amrex +cuda cuda_arch=90 | ||||
|   - arborx +cuda cuda_arch=90 ^kokkos +wrapper | ||||
|   | ||||
| @@ -197,6 +197,25 @@ spack: | ||||
|   # - quantum-espresso                                        # quantum-espresso@7.2 /i3fqdx5: warning: <unknown>:0:0: loop not unroll-and-jammed: the optimizer was unable to perform the requested transformation; the transformation might be disabled or specified as part of an unsupported transformation ordering | ||||
|   # - tau +mpi +python +syscall                               # pdt: pdbType.cc:193:21: warning: ISO C++11 does not allow conversion from string literal to 'char *' [-Wwritable-strings] | ||||
|  | ||||
|   # PYTHON PACKAGES | ||||
|   - opencv +python3 | ||||
|   # - py-horovod # error | ||||
|   # - py-jax # error | ||||
|   - py-jupyterlab | ||||
|   # - py-matplotlib #  error | ||||
|   - py-notebook | ||||
|   - py-numpy | ||||
|   - py-openai | ||||
|   - py-pandas | ||||
|   - py-plotly | ||||
|   - py-pooch | ||||
|   - py-pytest | ||||
|   - py-scikit-learn | ||||
|   - py-scipy | ||||
|   - py-seaborn | ||||
|   # - py-tensorflow # error | ||||
|   # - py-torch # error | ||||
|  | ||||
|   # GPU | ||||
|   - amrex +sycl | ||||
|   - tau +mpi +opencl +level_zero ~pdt +syscall                # requires libdrm.so to be installed | ||||
|   | ||||
| @@ -183,6 +183,25 @@ spack: | ||||
|   # - phist +mpi                            # ghost@develop: gcc-9: error: unrecognized command line option '-march=native'; did you mean '-mcpu=native'? | ||||
|   # - variorum                              # variorum: https://github.com/spack/spack/issues/38786 | ||||
|  | ||||
|   # PYTHON PACKAGES | ||||
|   - opencv +python3 | ||||
|   # - py-horovod # py-torch, py-tensorflow | ||||
|   - py-jax | ||||
|   - py-jupyterlab | ||||
|   - py-matplotlib | ||||
|   - py-notebook | ||||
|   - py-numpy | ||||
|   - py-openai | ||||
|   - py-pandas | ||||
|   - py-plotly | ||||
|   - py-pooch | ||||
|   - py-pytest | ||||
|   - py-scikit-learn | ||||
|   - py-scipy | ||||
|   - py-seaborn | ||||
|   # - py-tensorflow # error | ||||
|   # - py-torch # error | ||||
|  | ||||
|   # CUDA NOARCH | ||||
|   - bricks +cuda | ||||
|   - cabana +cuda ^kokkos +wrapper +cuda_lambda +cuda cuda_arch=70 | ||||
|   | ||||
| @@ -190,6 +190,25 @@ spack: | ||||
|   # - archer                          # submerged into llvm +libomp_tsan | ||||
|   # - geopm                           # geopm: https://github.com/spack/spack/issues/38795 | ||||
|  | ||||
|   # PYTHON PACKAGES | ||||
|   - opencv +python3 | ||||
|   - py-horovod | ||||
|   - py-jax | ||||
|   - py-jupyterlab | ||||
|   - py-matplotlib | ||||
|   - py-notebook | ||||
|   - py-numpy | ||||
|   - py-openai | ||||
|   - py-pandas | ||||
|   - py-plotly | ||||
|   - py-pooch | ||||
|   - py-pytest | ||||
|   - py-scikit-learn | ||||
|   - py-scipy | ||||
|   - py-seaborn | ||||
|   - py-tensorflow | ||||
|   - py-torch | ||||
|  | ||||
|   # CUDA NOARCH | ||||
|   - bricks +cuda | ||||
|   - flux-core +cuda | ||||
|   | ||||
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