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Goal: General process for creating and sharing a conda environment under a project.

Use Case

We want to create a software installation of TensorFlow (an end-to-end platform for machine learning) that can be shared acorss a project by all users.

From the documentation (as of time of writing):

  • The install documentation only details using a pip install.

  • TensorFlow is tested and supported on the following 64-bit systems: Python 3.8–3.11

General Process

[salexan5@mblog2 tensorflow]$ module load miniconda3/24.3.0
[salexan5@mblog2 tensorflow]$ conda create -p 2.16 python=3.11
[salexan5@mblog2 tensorflow]$ conda activate /cluster/medbow/project/arcc/software/tensorflow/2.16
(/cluster/medbow/project/arcc/software/tensorflow/2.16) [salexan5@mblog2 tensorflow]$ export PYTHONUSERBASE=$CONDA_PREFIX
(/cluster/medbow/project/arcc/software/tensorflow/2.16) [salexan5@mblog2 tensorflow]$ echo $PYTHONUSERBASE
/cluster/medbow/project/arcc/software/tensorflow/2.16
(/cluster/medbow/project/arcc/software/tensorflow/2.16) [salexan5@mblog2 tensorflow]$ pip install tensorflow
(/cluster/medbow/project/arcc/software/tensorflow/2.16) [salexan5@mblog2 tensorflow]$ python --version
Python 3.11.9

(/cluster/medbow/project/arcc/software/tensorflow/2.16) [salexan5@mblog2 tensorflow]$ python ~/tf_test.py
...
TensorFlow Version: 2.16.1
tf.Tensor(997.42975, shape=(), dtype=float32)
(/cluster/medbow/project/arcc/software/tensorflow/2.16) [salexan5@mblog2 tensorflow]$ conda deactivate
[salexan5@mblog2 tensorflow]$
 tf_test.py
import tensorflow as tf
print("TensorFlow Version: " + str( tf.__version__))
print(tf.reduce_sum(tf.random.normal([1000, 1000])))
 Full pip install:
(/cluster/medbow/project/arcc/software/tensorflow/2.16) [salexan5@mblog2 tensorflow]$ pip install tensorflow
Collecting tensorflow
  Downloading tensorflow-2.16.1-cp311-cp311-manylinux_2_17_x86_64.manylinux2014_x86_64.whl.metadata (4.3 kB)
Collecting absl-py>=1.0.0 (from tensorflow)
  Downloading absl_py-2.1.0-py3-none-any.whl.metadata (2.3 kB)
Collecting astunparse>=1.6.0 (from tensorflow)
  Downloading astunparse-1.6.3-py2.py3-none-any.whl.metadata (4.4 kB)
Collecting flatbuffers>=23.5.26 (from tensorflow)
  Downloading flatbuffers-24.3.25-py2.py3-none-any.whl.metadata (850 bytes)
Collecting gast!=0.5.0,!=0.5.1,!=0.5.2,>=0.2.1 (from tensorflow)
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Collecting google-pasta>=0.1.1 (from tensorflow)
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Collecting h5py>=3.10.0 (from tensorflow)
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Collecting libclang>=13.0.0 (from tensorflow)
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Collecting ml-dtypes~=0.3.1 (from tensorflow)
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Collecting opt-einsum>=2.3.2 (from tensorflow)
  Downloading opt_einsum-3.3.0-py3-none-any.whl.metadata (6.5 kB)
Collecting packaging (from tensorflow)
  Downloading packaging-24.1-py3-none-any.whl.metadata (3.2 kB)
Collecting protobuf!=4.21.0,!=4.21.1,!=4.21.2,!=4.21.3,!=4.21.4,!=4.21.5,<5.0.0dev,>=3.20.3 (from tensorflow)
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Collecting requests<3,>=2.21.0 (from tensorflow)
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Requirement already satisfied: setuptools in ./2.16/lib/python3.11/site-packages (from tensorflow) (70.1.0)
Collecting six>=1.12.0 (from tensorflow)
  Using cached six-1.16.0-py2.py3-none-any.whl.metadata (1.8 kB)
Collecting termcolor>=1.1.0 (from tensorflow)
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Collecting typing-extensions>=3.6.6 (from tensorflow)
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Collecting wrapt>=1.11.0 (from tensorflow)
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Collecting grpcio<2.0,>=1.24.3 (from tensorflow)
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Collecting tensorboard<2.17,>=2.16 (from tensorflow)
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Collecting keras>=3.0.0 (from tensorflow)
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Collecting tensorflow-io-gcs-filesystem>=0.23.1 (from tensorflow)
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Collecting numpy<2.0.0,>=1.23.5 (from tensorflow)
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Collecting markdown>=2.6.8 (from tensorboard<2.17,>=2.16->tensorflow)
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Collecting tensorboard-data-server<0.8.0,>=0.7.0 (from tensorboard<2.17,>=2.16->tensorflow)
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Installing collected packages: namex, libclang, flatbuffers, wrapt, urllib3, typing-extensions, termcolor, tensorflow-io-gcs-filesystem, tensorboard-data-server, six, pygments, protobuf, packaging, numpy, mdurl, MarkupSafe, markdown, idna, grpcio, gast, charset-normalizer, certifi, absl-py, werkzeug, requests, optree, opt-einsum, ml-dtypes, markdown-it-py, h5py, google-pasta, astunparse, tensorboard, rich, keras, tensorflow
Successfully installed MarkupSafe-2.1.5 absl-py-2.1.0 astunparse-1.6.3 certifi-2024.6.2 charset-normalizer-3.3.2 flatbuffers-24.3.25 gast-0.5.4 google-pasta-0.2.0 grpcio-1.64.1 h5py-3.11.0 idna-3.7 keras-3.3.3 libclang-18.1.1 markdown-3.6 markdown-it-py-3.0.0 mdurl-0.1.2 ml-dtypes-0.3.2 namex-0.0.8 numpy-1.26.4 opt-einsum-3.3.0 optree-0.11.0 packaging-24.1 protobuf-4.25.3 pygments-2.18.0 requests-2.32.3 rich-13.7.1 six-1.16.0 tensorboard-2.16.2 tensorboard-data-server-0.7.2 tensorflow-2.16.1 tensorflow-io-gcs-filesystem-0.37.0 termcolor-2.4.0 typing-extensions-4.12.2 urllib3-2.2.2 werkzeug-3.0.3 wrapt-1.16.0

Notice Where Related Packages Were Installed

Since we set export PYTHONUSERBASE=$CONDA_PREFIX there is nothing within the home folder under: .local/lib/ i.e. no Python3.11 folder:

[salexan5@mblog1 ~]$ ls .local/lib/
python3.10  python3.12

Everything is self contained within the conda environment itself:

(/cluster/medbow/project/arcc/software/tensorflow/2.16) [salexan5@mblog2 tensorflow]$ pwd
/project/arcc/software/tensorflow

(/cluster/medbow/project/arcc/software/tensorflow/2.16) [salexan5@mblog2 tensorflow]$ ls 2.16/lib/python3.11/site-packages/
absl                                grpc                            mdurl-0.1.2.dist-info       pkg_resources                      tensorboard_data_server-0.7.2.dist-info
absl_py-2.1.0.dist-info             grpcio-1.64.1.dist-info         ml_dtypes                   protobuf-4.25.3.dist-info          tensorflow
astunparse                          h5py                            ml_dtypes-0.3.2.dist-info   __pycache__                        tensorflow-2.16.1.dist-info
astunparse-1.6.3.dist-info          h5py-3.11.0.dist-info           namex                       pygments                           tensorflow_io_gcs_filesystem
certifi                             h5py.libs                       namex-0.0.8.dist-info       pygments-2.18.0.dist-info          tensorflow_io_gcs_filesystem-0.37.0.dist-info
...

How is this Shared?

Since wwe created this environment under a project, any one part of this project can also access this environment.

[salexan5@mblog2 tensorflow]$ pwd
/project/arcc/software/tensorflow
[salexan5@mblog2 tensorflow]$ ls -al
...
drwxr-sr-x 2 salexan5 arcc 4096 Jun 24 16:33 2.16

The user brewer is part of the arcc project.

[brewer@mblog2 ~]$ module load miniconda3/24.3.0
[brewer@mblog2 ~]$ conda activate /project/arcc/software/tensorflow/2.16/
(/project/arcc/software/tensorflow/2.16) [brewer@mblog2 ~]$ python -c "import tensorflow as tf; print(\"TensorFlow Version: \" + str( tf.__version__))"
...
TensorFlow Version: 2.16.1
(/project/arcc/software/tensorflow/2.16) [brewer@mblog2 ~]$ conda deactivate
[brewer@mblog2 ~]$

Pip Install within a Conda Environment

 

Create a Module File to Load Your Conda Environment

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