workbench 0.8.161__py3-none-any.whl → 0.8.192__py3-none-any.whl

This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
Files changed (96) hide show
  1. workbench/algorithms/dataframe/proximity.py +143 -102
  2. workbench/algorithms/graph/light/proximity_graph.py +2 -1
  3. workbench/api/compound.py +1 -1
  4. workbench/api/endpoint.py +12 -0
  5. workbench/api/feature_set.py +4 -4
  6. workbench/api/meta.py +5 -2
  7. workbench/api/model.py +16 -12
  8. workbench/api/monitor.py +1 -16
  9. workbench/core/artifacts/artifact.py +11 -3
  10. workbench/core/artifacts/data_capture_core.py +355 -0
  11. workbench/core/artifacts/endpoint_core.py +168 -78
  12. workbench/core/artifacts/feature_set_core.py +72 -13
  13. workbench/core/artifacts/model_core.py +50 -15
  14. workbench/core/artifacts/monitor_core.py +33 -248
  15. workbench/core/cloud_platform/aws/aws_account_clamp.py +50 -1
  16. workbench/core/cloud_platform/aws/aws_meta.py +12 -5
  17. workbench/core/cloud_platform/aws/aws_session.py +4 -4
  18. workbench/core/transforms/data_to_features/light/molecular_descriptors.py +4 -4
  19. workbench/core/transforms/features_to_model/features_to_model.py +9 -4
  20. workbench/core/transforms/model_to_endpoint/model_to_endpoint.py +36 -6
  21. workbench/core/transforms/pandas_transforms/pandas_to_features.py +27 -0
  22. workbench/core/views/training_view.py +49 -53
  23. workbench/core/views/view.py +51 -1
  24. workbench/core/views/view_utils.py +4 -4
  25. workbench/model_scripts/custom_models/chem_info/mol_descriptors.py +483 -0
  26. workbench/model_scripts/custom_models/chem_info/mol_standardize.py +450 -0
  27. workbench/model_scripts/custom_models/chem_info/molecular_descriptors.py +7 -9
  28. workbench/model_scripts/custom_models/proximity/feature_space_proximity.template +3 -5
  29. workbench/model_scripts/custom_models/proximity/proximity.py +143 -102
  30. workbench/model_scripts/custom_models/uq_models/bayesian_ridge.template +7 -8
  31. workbench/model_scripts/custom_models/uq_models/ensemble_xgb.template +10 -17
  32. workbench/model_scripts/custom_models/uq_models/gaussian_process.template +5 -11
  33. workbench/model_scripts/custom_models/uq_models/meta_uq.template +156 -58
  34. workbench/model_scripts/custom_models/uq_models/ngboost.template +20 -14
  35. workbench/model_scripts/custom_models/uq_models/proximity.py +143 -102
  36. workbench/model_scripts/custom_models/uq_models/requirements.txt +1 -3
  37. workbench/model_scripts/ensemble_xgb/ensemble_xgb.template +5 -13
  38. workbench/model_scripts/pytorch_model/pytorch.template +19 -20
  39. workbench/model_scripts/scikit_learn/scikit_learn.template +4 -9
  40. workbench/model_scripts/script_generation.py +7 -2
  41. workbench/model_scripts/uq_models/mapie.template +492 -0
  42. workbench/model_scripts/uq_models/requirements.txt +1 -0
  43. workbench/model_scripts/xgb_model/xgb_model.template +31 -40
  44. workbench/repl/workbench_shell.py +11 -6
  45. workbench/scripts/lambda_launcher.py +63 -0
  46. workbench/scripts/ml_pipeline_batch.py +137 -0
  47. workbench/scripts/ml_pipeline_sqs.py +186 -0
  48. workbench/scripts/monitor_cloud_watch.py +20 -100
  49. workbench/utils/aws_utils.py +4 -3
  50. workbench/utils/chem_utils/__init__.py +0 -0
  51. workbench/utils/chem_utils/fingerprints.py +134 -0
  52. workbench/utils/chem_utils/misc.py +194 -0
  53. workbench/utils/chem_utils/mol_descriptors.py +483 -0
  54. workbench/utils/chem_utils/mol_standardize.py +450 -0
  55. workbench/utils/chem_utils/mol_tagging.py +348 -0
  56. workbench/utils/chem_utils/projections.py +209 -0
  57. workbench/utils/chem_utils/salts.py +256 -0
  58. workbench/utils/chem_utils/sdf.py +292 -0
  59. workbench/utils/chem_utils/toxicity.py +250 -0
  60. workbench/utils/chem_utils/vis.py +253 -0
  61. workbench/utils/cloudwatch_handler.py +1 -1
  62. workbench/utils/cloudwatch_utils.py +137 -0
  63. workbench/utils/config_manager.py +3 -7
  64. workbench/utils/endpoint_utils.py +5 -7
  65. workbench/utils/license_manager.py +2 -6
  66. workbench/utils/model_utils.py +76 -30
  67. workbench/utils/monitor_utils.py +44 -62
  68. workbench/utils/pandas_utils.py +3 -3
  69. workbench/utils/shap_utils.py +10 -2
  70. workbench/utils/workbench_logging.py +0 -3
  71. workbench/utils/workbench_sqs.py +1 -1
  72. workbench/utils/xgboost_model_utils.py +283 -145
  73. workbench/web_interface/components/plugins/dashboard_status.py +3 -1
  74. workbench/web_interface/components/plugins/generated_compounds.py +1 -1
  75. workbench/web_interface/components/plugins/scatter_plot.py +3 -3
  76. {workbench-0.8.161.dist-info → workbench-0.8.192.dist-info}/METADATA +4 -4
  77. {workbench-0.8.161.dist-info → workbench-0.8.192.dist-info}/RECORD +81 -76
  78. {workbench-0.8.161.dist-info → workbench-0.8.192.dist-info}/entry_points.txt +3 -0
  79. workbench/model_scripts/custom_models/chem_info/local_utils.py +0 -769
  80. workbench/model_scripts/custom_models/chem_info/tautomerize.py +0 -83
  81. workbench/model_scripts/custom_models/proximity/generated_model_script.py +0 -138
  82. workbench/model_scripts/custom_models/uq_models/generated_model_script.py +0 -393
  83. workbench/model_scripts/custom_models/uq_models/mapie_xgb.template +0 -203
  84. workbench/model_scripts/ensemble_xgb/generated_model_script.py +0 -279
  85. workbench/model_scripts/pytorch_model/generated_model_script.py +0 -565
  86. workbench/model_scripts/quant_regression/quant_regression.template +0 -279
  87. workbench/model_scripts/quant_regression/requirements.txt +0 -1
  88. workbench/model_scripts/scikit_learn/generated_model_script.py +0 -307
  89. workbench/model_scripts/xgb_model/generated_model_script.py +0 -477
  90. workbench/utils/chem_utils.py +0 -1556
  91. workbench/utils/execution_environment.py +0 -211
  92. workbench/utils/fast_inference.py +0 -167
  93. workbench/utils/resource_utils.py +0 -39
  94. {workbench-0.8.161.dist-info → workbench-0.8.192.dist-info}/WHEEL +0 -0
  95. {workbench-0.8.161.dist-info → workbench-0.8.192.dist-info}/licenses/LICENSE +0 -0
  96. {workbench-0.8.161.dist-info → workbench-0.8.192.dist-info}/top_level.txt +0 -0
@@ -1,6 +1,6 @@
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  Metadata-Version: 2.4
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  Name: workbench
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- Version: 0.8.161
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+ Version: 0.8.192
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  Summary: Workbench: A Dashboard and Python API for creating and deploying AWS SageMaker Model Pipelines
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  Author-email: SuperCowPowers LLC <support@supercowpowers.com>
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  License-Expression: MIT
@@ -10,6 +10,7 @@ Classifier: Development Status :: 4 - Beta
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  Classifier: Programming Language :: Python :: 3.10
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  Classifier: Programming Language :: Python :: 3.11
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  Classifier: Programming Language :: Python :: 3.12
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+ Classifier: Programming Language :: Python :: 3.13
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  Classifier: Topic :: Scientific/Engineering
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  Requires-Python: >=3.10
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  Description-Content-Type: text/markdown
@@ -22,7 +23,7 @@ Requires-Dist: pandas>=2.2.1
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  Requires-Dist: awswrangler>=3.4.0
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  Requires-Dist: sagemaker>=2.143
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  Requires-Dist: cryptography>=44.0.2
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- Requires-Dist: ipython>=9.0.0
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+ Requires-Dist: ipython>=8.37.0
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  Requires-Dist: pyreadline3; sys_platform == "win32"
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  Requires-Dist: scikit-learn>=1.5.2
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  Requires-Dist: xgboost>=3.0.3
@@ -30,7 +31,7 @@ Requires-Dist: joblib>=1.3.2
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  Requires-Dist: requests>=2.26.0
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  Requires-Dist: rdkit>=2024.9.5
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  Requires-Dist: mordredcommunity>=2.0.6
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- Requires-Dist: workbench-bridges>=0.1.8
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+ Requires-Dist: workbench-bridges>=0.1.10
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  Provides-Extra: ui
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  Requires-Dist: plotly>=6.0.0; extra == "ui"
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  Requires-Dist: dash>3.0.0; extra == "ui"
@@ -168,7 +169,6 @@ Using Workbench will minimize the time and manpower needed to incorporate AWS ML
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  ```
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  pip install workbench # Installs Workbench with Core Dependencies
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- pip install 'workbench[ml-tools]' # + Shap and NetworkX
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  pip install 'workbench[ui]' # + Plotly/Dash
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  pip install 'workbench[dev]' # + Pytest/flake8/black
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  pip install 'workbench[all]' # + All the things :)
@@ -6,7 +6,7 @@ workbench/algorithms/dataframe/data_source_eda.py,sha256=WgVL6tzBCw1tznQr8RQ6daQ
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  workbench/algorithms/dataframe/feature_space_proximity.py,sha256=6RxzvbpLdDkHMm1D49Nv59SFcyYUj8bisd6_5EpBEGI,3515
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  workbench/algorithms/dataframe/fingerprint_proximity.py,sha256=zqvk2WfY_nRFGC5bYcBbooGfSZsAhZBS8HNQ0GSMpwg,5838
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  workbench/algorithms/dataframe/projection_2d.py,sha256=zK4hc0OQrySmfcfFg8y0GxEL34uDNqvZL4OgttB9vRs,7834
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- workbench/algorithms/dataframe/proximity.py,sha256=zqmNlX70LnWXr5fdtFFQppSNTLjlOciQVrjGr-g9jRE,13716
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+ workbench/algorithms/dataframe/proximity.py,sha256=P8f3GHRhuc4QHj5KkKW0JMrHhIo2QdBiFG-JituTV1U,14633
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  workbench/algorithms/dataframe/storage/aggregation.py,sha256=VuTb7A6Vh6IS5djZeItvOLnnEOlf7tzMQ8OaYIuftvU,2852
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  workbench/algorithms/dataframe/storage/feature_resolution.py,sha256=w_iLf8EFTg7Jc5laH-bsq8MEtZVqcg05W-GihCqR-r4,9450
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  workbench/algorithms/dataframe/storage/feature_spider.py,sha256=uIZ4JHIKuhpy08wBFReSrohb5DGxx8vGroHUbjPm1jE,14353
@@ -17,7 +17,7 @@ workbench/algorithms/graph/__init__.py,sha256=Hi2vBi-qw2OPLZnCu5qVTDdorRMOd3wNIt
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  workbench/algorithms/graph/heavy/Readme.md,sha256=QzefnMevGXHBtaP3umzMNn2KEdNQMvJkJNbhkrUw7QE,96
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  workbench/algorithms/graph/light/Readme.md,sha256=8kP_hRrRC6JtKtl5qyTwrV6gdO5rz6uq54c8WW1fTLg,122
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  workbench/algorithms/graph/light/__init__.py,sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU,0
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- workbench/algorithms/graph/light/proximity_graph.py,sha256=2mb1BLMdKX1NZbhNX3OGcpYED2RHJlTh4l7nd_0jAXE,9584
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+ workbench/algorithms/graph/light/proximity_graph.py,sha256=cwPqyswX4l4my8yGyC3LDZ0Jc5ZkVFx3N6W8xFxfzEY,9651
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  workbench/algorithms/spark/Readme.md,sha256=18bPoFISlT3Ls5t1cBGb5N5Z6lOWyJupQkQxab1wcO4,615
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  workbench/algorithms/sql/Readme.md,sha256=fzm4jQ-unJWT-fp5JhIjpApYSAqHUGSiuHE0eNfbF4A,685
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  workbench/algorithms/sql/__init__.py,sha256=TbOZQwCfx6Tjc3pCCLCiM31wpCX26j5MBNQ6yG11EwY,462
@@ -28,15 +28,15 @@ workbench/algorithms/sql/outliers.py,sha256=2hoilOk0gaz9pwrnGEBY2y7M-UqFED3KO_mF
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  workbench/algorithms/sql/sample_rows.py,sha256=SRYoGb24QP_iPvOoW9bGZ95yZuseYDtyoNhilfoLu34,2688
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  workbench/algorithms/sql/value_counts.py,sha256=F-rZoLTTKv1cHYl2_tDlvWDjczy76uLTr3EMHa-WrEk,3340
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  workbench/api/__init__.py,sha256=kvrP70ypDOMdPGj_Eeftdh8J0lu_1qQVne6GXMkD4_E,1027
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- workbench/api/compound.py,sha256=BHd3Qu4Ra45FEuwiowhFfGMI_HKRRB10XMmoS6ljKrM,2541
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+ workbench/api/compound.py,sha256=kf5EaM5qjWwsZutcxqj9IC_MPnDV1uVHDMns9OA_GOo,2545
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  workbench/api/data_source.py,sha256=Ngz36YZWxFfpJbmURhM1LQPYjh5kdpZNGo6_fCRePbA,8321
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  workbench/api/df_store.py,sha256=Wybb3zO-jPpAi2Ns8Ks1-lagvXAaBlRpBZHhnnl3Lms,6131
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- workbench/api/endpoint.py,sha256=ejDnfBBgNYMZB-bOA5nX7C6CtBlAjmtrF8M_zpri9Io,3451
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- workbench/api/feature_set.py,sha256=wzNxNjN0K2FaIC7QUIogMnoHqw2vo0iAHYlGk6fWLCw,6649
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+ workbench/api/endpoint.py,sha256=RDQs78OFRSp9GYGHHph0gLtAfF4p3We96bzdJ4-9bzw,3926
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+ workbench/api/feature_set.py,sha256=Yxei3tvWR4gSLcdJnNndux07dNeKNu1HKgsChJtHxEM,6633
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  workbench/api/graph_store.py,sha256=LremJyPrQFgsHb7hxsctuCsoxx3p7TKtaY5qALHe6pc,4372
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- workbench/api/meta.py,sha256=fCOtZMfAHWaerzcsTeFnimXfgV8STe9JDiB7QBogktc,8456
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- workbench/api/model.py,sha256=2hPN8UK4whZ0kDgPtbR7lEknw7XhH5hGYaHA55jmZWQ,4529
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- workbench/api/monitor.py,sha256=kQHSFiVLRWnHekSdatMKR3QbRj1BBNrVXpZgvV83LPM,5027
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+ workbench/api/meta.py,sha256=1_9989cPvf3hd3tA-83hLijOGNnhwXAF8aZF45adeDQ,8596
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+ workbench/api/model.py,sha256=coIl2QwbfyeVBM_Y2SaU587ioBh2TTDC9r9bOuYme9U,4605
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+ workbench/api/monitor.py,sha256=Cez89Uac7Tzt47FxkjoX-YDGccEhvBcxw3sZFtw4ud8,4506
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  workbench/api/parameter_store.py,sha256=7BObkuATuP6C5AG_46kCWsmuCwuh1vgMJDBSN0gTkwM,4294
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  workbench/api/pipeline.py,sha256=MSYGrDSXrRB_oQELtAlOwBfxSBTw3REAkHy5XBHau0Y,6261
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  workbench/cached/__init__.py,sha256=wvTyIFvusv2HjU3yop6OSr3js5_-SZuR8nPmlCuZQJ4,525
@@ -48,24 +48,25 @@ workbench/cached/cached_model.py,sha256=iMc_fySUE5qau3feduVXMNb24JY0sBjt1g6WeLLc
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  workbench/cached/cached_pipeline.py,sha256=QOVnEKu5RbIdlNpJUi-0Ebh0_-C68RigSPwKh4dvZTM,1948
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  workbench/core/__init__.py,sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU,0
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  workbench/core/artifacts/__init__.py,sha256=ps7rA_rbWnDbvWbg4kvu--IKMY8WmbPRyv4Si0xub1Q,965
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- workbench/core/artifacts/artifact.py,sha256=mF1lqQ8EP43zMRSxqPYuWoHRwQTjyWdpW9LewU7utEE,17517
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+ workbench/core/artifacts/artifact.py,sha256=WFGC1F61d7uFSRB7UTWYOF8O_wk8F9rn__THJL2veLM,17752
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  workbench/core/artifacts/athena_source.py,sha256=RNmCe7s6uH4gVHpcdJcL84aSbF5Q1ahJBLLGwHYRXEU,26081
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  workbench/core/artifacts/cached_artifact_mixin.py,sha256=ngqFLZ4cQx_TFouXZgXZQsv_7W6XCvxVGXXSfzzaft8,3775
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+ workbench/core/artifacts/data_capture_core.py,sha256=q8f79rRTYiZ7T4IQRWXl8ZvPpcvZyNxYERwvo8o0OQc,14858
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  workbench/core/artifacts/data_source_abstract.py,sha256=5IRCzFVK-17cd4NXPMRfx99vQAmQ0WHE5jcm5RfsVTg,10619
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  workbench/core/artifacts/data_source_factory.py,sha256=YL_tA5fsgubbB3dPF6T4tO0rGgz-6oo3ge4i_YXVC-M,2380
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- workbench/core/artifacts/endpoint_core.py,sha256=L6uWOxHKItjbpRS2rFrAbxAqDyZIv2CO9dnZpohKrUI,48768
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- workbench/core/artifacts/feature_set_core.py,sha256=055VdSYR09HP4ygAuYvIYtHQ7Ec4XxsZygpgEl5H5jQ,29136
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- workbench/core/artifacts/model_core.py,sha256=U0dSkpZMrsIgbUglVkPwAgN0gji7Oa7glOjqMQJDAzE,50927
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- workbench/core/artifacts/monitor_core.py,sha256=BP6UuCyBI4zB2wwcIXvUw6RC0EktTcQd5Rv0x73qzio,37670
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+ workbench/core/artifacts/endpoint_core.py,sha256=VH-q-R4pfKyjCOXl2Gq1pxMNf4Ir0YdMw9YIHqd7CVU,51974
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+ workbench/core/artifacts/feature_set_core.py,sha256=6qOJoJ9_qwtyz4neFY6vMn73Ujjeut7E0dy_e8nYfSE,31462
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+ workbench/core/artifacts/model_core.py,sha256=vVERAD7cmYW8Y9tG8FmT7GMCWiudj8rJ4wfmucWrHUI,52287
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+ workbench/core/artifacts/monitor_core.py,sha256=M307yz7tEzOEHgv-LmtVy9jKjSbM98fHW3ckmNYrwlU,27897
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  workbench/core/cloud_platform/cloud_meta.py,sha256=-g4-LTC3D0PXb3VfaXdLR1ERijKuHdffeMK_zhD-koQ,8809
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- workbench/core/cloud_platform/aws/aws_account_clamp.py,sha256=OzFknZXKW7VTvnDGGX4BXKoh0i1gQ7yaEBhkLCyHFSs,6310
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+ workbench/core/cloud_platform/aws/aws_account_clamp.py,sha256=V5iVsoGvSRilARtTdExnt27QptzAcJaW0s3nm2B8-ow,8286
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- workbench/core/cloud_platform/aws/aws_meta.py,sha256=ZCKr4cMc0XE9HC0FnLJM1wS85kK8zbzo54OIRN7MiLE,34591
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+ workbench/core/cloud_platform/aws/aws_meta.py,sha256=eY9Pn6pl2yAyseACFb2nitR-0vLwG4i8CSEXe8Iaswc,34778
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- workbench/core/cloud_platform/aws/aws_session.py,sha256=IIGz0ekbNunWzQaeaZzC2-Vl49o4Lv2F35vLtgjMGsQ,6972
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+ workbench/core/cloud_platform/aws/aws_session.py,sha256=2Gc_k4Q87BBeQDgXgVR-w-qmsF6ncZR8wvTeNnixM6k,6926
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  workbench/core/cloud_platform/gcp/README.md,sha256=MzObe3mWQzjviKD2aXlAV9r_bU4HzTJGapWRsFn6pCU,106
@@ -96,19 +97,19 @@ workbench/core/transforms/data_to_features/heavy/glue/Readme.md,sha256=TuyCatWfo
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  workbench/core/transforms/data_to_features/heavy/storage/data_to_features_heavy_old.py,sha256=tIfmnUjUAYpJhyHjHmM2D6jIt1pN7SabBqS8exV6f40,6438
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- workbench/core/transforms/data_to_features/light/molecular_descriptors.py,sha256=lxbK8EO4GdBs56mNNjf6GuE9ciNcVUolqcmlVT-0HsE,2460
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+ workbench/scripts/lambda_launcher.py,sha256=8-zzsyuzxI8qX66DGpJ1fCJVU0QCfTGdaPqBsJXPr-M,1877
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+ workbench/scripts/ml_pipeline_batch.py,sha256=1T5JnLlUJR7bwAGBLHmLPOuj1xFRqVIQX8PsuDhHy8o,4907
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+ workbench/scripts/ml_pipeline_sqs.py,sha256=5c8qX-SoV4htOUcSXk4OzD7BQskCnaA7cLMiF4Et24c,6666
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- workbench/utils/cloudwatch_handler.py,sha256=dtnkr8tXtTRAASQ60QO0lz3SRA5LEbzsK1VCIqblfKs,5157
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- workbench/utils/pandas_utils.py,sha256=LQTfZ3WJkg3rIahNJhsz1YV2y_0DBG94lO-KMmEY1g0,39325
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+ workbench/utils/model_utils.py,sha256=THs0GXkZdJLkk-sMxEo_wu7-ouGrJZdlN99yDUzO5xk,13515
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+ workbench/utils/monitor_utils.py,sha256=kVaJ7BgUXs3VPMFYfLC03wkIV4Dq-pEhoXS0wkJFxCc,7858
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+ workbench/utils/pandas_utils.py,sha256=uTUx-d1KYfjbS9PMQp2_9FogCV7xVZR6XLzU5YAGmfs,39371
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- workbench/utils/shap_utils.py,sha256=gbrwha7hu64xmMGqr__kQXrMXwJpKHrYghh9RYP62OE,12346
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+ workbench/utils/shap_utils.py,sha256=dtjSIwSyvYSaQjjvIp5A9LGS7pr-5Vt907rvVKOrqNY,12651
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@@ -239,9 +233,20 @@ workbench/utils/trace_calls.py,sha256=tY4DOVMGXBh-mbUWzo1l-X9XjD0ux_qR9I1ypkjWNI
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- workbench/utils/workbench_logging.py,sha256=aOUjMZeKqrK03z5mwuVAAwwjIjVxyTA7g-brr85oxY8,10424
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- workbench/utils/workbench_sqs.py,sha256=WFQTqOxoEdOzPEMmTVZcdPzylmkynZ5aKtvRrOAO06w,2127
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- workbench/utils/xgboost_model_utils.py,sha256=AEBSyIXYFk6vI3u89w7J4VdI1dgNJOgQe6XZv4pUhOM,15501
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+ workbench/utils/workbench_logging.py,sha256=WCuMWhQwibrvcGAyj96h2wowh6dH7zNlDJ7sWUzdCeI,10263
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+ workbench/utils/xgboost_model_utils.py,sha256=K0lbeb6LpS5oyN8cmK5Mfzz89n9q3p6ikvN39U9rvQw,22090
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+ workbench/utils/chem_utils/__init__.py,sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU,0
240
+ workbench/utils/chem_utils/fingerprints.py,sha256=Qvs8jaUwguWUq3Q3j695MY0t0Wk3BvroW-oWBwalMUo,5255
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+ workbench/utils/chem_utils/misc.py,sha256=Nevf8_opu-uIPrv_1_0ubuFVVo2_fGUkMoLAHB3XAeo,7372
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+ workbench/utils/chem_utils/mol_descriptors.py,sha256=c8gkHZ-8s3HJaW9zN9pnYGK7YVW8Y0xFqQ1G_ysrF2Y,18789
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+ workbench/utils/chem_utils/mol_standardize.py,sha256=qPLCdVMSXMOWN-01O1isg2zq7eQyFAI0SNatHkRq1uw,17524
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+ workbench/utils/chem_utils/mol_tagging.py,sha256=8Bt6gHvyN8B2jvVuz12JgYMHVLDkCLnEPAfqkyMEoMc,9995
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+ workbench/utils/chem_utils/projections.py,sha256=smV-VTB-pqRrgn4DXyDIpuCYcopJdPZ54YoCQv60JY0,7480
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+ workbench/utils/chem_utils/salts.py,sha256=ZzFb6Z71Z_kMjVF-PKwHx0fn9pN9rPMj-oEY8Nt5JWA,9095
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+ workbench/utils/chem_utils/sdf.py,sha256=wucyMtnmdg6onBa5N_sX6ONDE4PThJokImFxCBk22RI,10319
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+ workbench/utils/chem_utils/toxicity.py,sha256=OmVvR05XjP8rLteQ0gjlC5tRh3WitjoahPnSLPhbUXQ,10195
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+ workbench/utils/chem_utils/vis.py,sha256=ZnNv2o0mab3z09FP8oqtT3z7bAPtBJ61p5u15A2LR1s,8713
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- workbench/web_interface/components/plugins/dashboard_status.py,sha256=8Tu38lR5YgntxDjz_x2XfLiW7SOdreNLOFT5VkbYzKo,5748
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+ workbench/web_interface/components/plugins/dashboard_status.py,sha256=4plmoiXj3dDjoQerUNpep_jfk50pI9rHvcoSP20UbE8,5832
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- workbench/web_interface/components/plugins/generated_compounds.py,sha256=hC0sh-1_rbN55Huno-E_2wF37kgIHi5Mtaer6Xk5fRM,8052
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+ workbench/web_interface/components/plugins/generated_compounds.py,sha256=A6JGlkl7buZUugPK21YgufVFDRoGlHJowaqf8PAmz_s,8056
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  workbench/web_interface/components/plugins/graph_plot.py,sha256=JFzuSH_CkEmlaLAgFpzmiEpS3sXov0ycnCfP0VLsK2g,14502
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  workbench/web_interface/components/plugins/model_details.py,sha256=BBvT3zdGHpRWz4V9SpNO0AFMPaExWMbNAE1_onfCGRI,10294
@@ -266,7 +271,7 @@ workbench/web_interface/components/plugins/molecule_panel.py,sha256=xGCEI5af8F5l
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  workbench/web_interface/components/plugins/proximity_mini_graph.py,sha256=b_YYnvLczJUhaDbrrXnyjUDYF7C4R4ufCZXtJiyRnJ0,7233
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- workbench/web_interface/components/plugins/scatter_plot.py,sha256=j8J1-m_xZjG0hgaMevbRvKaTAze0GglpMMDlP3WA_6U,19106
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+ workbench/web_interface/components/plugins/scatter_plot.py,sha256=8tYnHlgi2UnuKLoxi9-89QF8ZHFrPhpRkzBY5gzlVdo,19130
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  workbench/web_interface/page_views/data_sources_page_view.py,sha256=SXNUG6n_eP9i4anddEXd5E9rMRt-R2EyNR-bbe8OQK4,4673
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  workbench/web_interface/page_views/endpoints_page_view.py,sha256=EI3hA18pEn-mAPEzGAw0W-wM8qJR2j_8pQEJlbJCENk,2770
@@ -275,9 +280,9 @@ workbench/web_interface/page_views/main_page.py,sha256=X4-KyGTKLAdxR-Zk2niuLJB2Y
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- workbench-0.8.161.dist-info/licenses/LICENSE,sha256=z4QMMPlLJkZjU8VOKqJkZiQZCEZ--saIU2Z8-p3aVc0,1080
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- workbench-0.8.161.dist-info/METADATA,sha256=ruPwlW-aucB_XxYedp4FMNjzlaAHkFzZw_PyV8ulWBo,9264
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- workbench-0.8.161.dist-info/WHEEL,sha256=_zCd3N1l69ArxyTb8rzEoP9TpbYXkqRFSNOD5OuxnTs,91
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- workbench-0.8.161.dist-info/entry_points.txt,sha256=oZykkheWiiIBjRE8cS5SdcxwmZKSFaQEGwMBjNh-eNM,238
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- workbench-0.8.161.dist-info/top_level.txt,sha256=Dhy72zTxaA_o_yRkPZx5zw-fwumnjGaeGf0hBN3jc_w,10
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- workbench-0.8.161.dist-info/RECORD,,
283
+ workbench-0.8.192.dist-info/licenses/LICENSE,sha256=z4QMMPlLJkZjU8VOKqJkZiQZCEZ--saIU2Z8-p3aVc0,1080
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+ workbench-0.8.192.dist-info/METADATA,sha256=dlskxjoY82E7I0Z-JwO802MdU6hTmk5eWD5hwn1ahq8,9261
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+ workbench-0.8.192.dist-info/top_level.txt,sha256=Dhy72zTxaA_o_yRkPZx5zw-fwumnjGaeGf0hBN3jc_w,10
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@@ -1,5 +1,8 @@
1
1
  [console_scripts]
2
2
  cloud_watch = workbench.scripts.monitor_cloud_watch:main
3
3
  glue_launcher = workbench.scripts.glue_launcher:main
4
+ lambda_launcher = workbench.scripts.lambda_launcher:main
5
+ ml_pipeline_batch = workbench.scripts.ml_pipeline_batch:main
6
+ ml_pipeline_sqs = workbench.scripts.ml_pipeline_sqs:main
4
7
  workbench = workbench.repl.workbench_shell:launch_shell
5
8
  workbench_config = workbench.scripts.show_config:main