2024-09-27T18:47:38,090 Created temporary directory: /tmp/pip-build-tracker-lp7qc5ch 2024-09-27T18:47:38,091 Initialized build tracking at /tmp/pip-build-tracker-lp7qc5ch 2024-09-27T18:47:38,091 Created build tracker: /tmp/pip-build-tracker-lp7qc5ch 2024-09-27T18:47:38,092 Entered build tracker: /tmp/pip-build-tracker-lp7qc5ch 2024-09-27T18:47:38,093 Created temporary directory: /tmp/pip-wheel-_owa3ouj 2024-09-27T18:47:38,096 Created temporary directory: /tmp/pip-ephem-wheel-cache-bm0md70o 2024-09-27T18:47:38,150 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-09-27T18:47:38,153 2 location(s) to search for versions of reinvent-hitl-scoring: 2024-09-27T18:47:38,153 * https://pypi.org/simple/reinvent-hitl-scoring/ 2024-09-27T18:47:38,153 * https://www.piwheels.org/simple/reinvent-hitl-scoring/ 2024-09-27T18:47:38,154 Fetching project page and analyzing links: https://pypi.org/simple/reinvent-hitl-scoring/ 2024-09-27T18:47:38,155 Getting page https://pypi.org/simple/reinvent-hitl-scoring/ 2024-09-27T18:47:38,156 Found index url https://pypi.org/simple/ 2024-09-27T18:47:38,303 Fetched page https://pypi.org/simple/reinvent-hitl-scoring/ as application/vnd.pypi.simple.v1+json 2024-09-27T18:47:38,307 Found link https://files.pythonhosted.org/packages/bf/5e/09cc4a22892e2f643836023cea7eab2ffc2b8ce006b86fa49e7381b76467/reinvent_hitl_scoring-0.0.6.tar.gz (from https://pypi.org/simple/reinvent-hitl-scoring/) (requires-python:>=3.7), version: 0.0.6 2024-09-27T18:47:38,308 Found link https://files.pythonhosted.org/packages/89/fa/670ef0e0db3baca8a0be038712de4125f616f52dab541aea44eb45c734e2/reinvent_hitl_scoring-0.0.7.tar.gz (from https://pypi.org/simple/reinvent-hitl-scoring/) (requires-python:>=3.7), version: 0.0.7 2024-09-27T18:47:38,309 Found link https://files.pythonhosted.org/packages/ff/04/0731ef4fb113d0fa0d547a63a5b0b433d2cf0588e278005724dc677cd0e1/reinvent_hitl_scoring-0.0.8.tar.gz (from https://pypi.org/simple/reinvent-hitl-scoring/) (requires-python:>=3.7), version: 0.0.8 2024-09-27T18:47:38,310 Found link https://files.pythonhosted.org/packages/15/86/5447436556096a9bee685088ccbb067f0ff451148af274585e12051a6ea9/reinvent_hitl_scoring-0.0.9.tar.gz (from https://pypi.org/simple/reinvent-hitl-scoring/) (requires-python:>=3.7), version: 0.0.9 2024-09-27T18:47:38,311 Found link https://files.pythonhosted.org/packages/ef/8a/75e03b00998279c24b45cf5d340e4cb12768edcd29576db3a678c7070aa4/reinvent_hitl_scoring-0.0.10.tar.gz (from https://pypi.org/simple/reinvent-hitl-scoring/) (requires-python:>=3.7), version: 0.0.10 2024-09-27T18:47:38,311 Skipping link: No binaries permitted for reinvent-hitl-scoring: https://files.pythonhosted.org/packages/33/f3/f5c2318a3aea97d5581ccc3c40120d40849e3a8138318bbe32a85dac4572/reinvent_hitl_scoring-0.0.11-py3-none-any.whl (from https://pypi.org/simple/reinvent-hitl-scoring/) (requires-python:>=3.7) 2024-09-27T18:47:38,312 Found link https://files.pythonhosted.org/packages/1f/ae/4d45ba9ceee38807f9c31256279cbcbd0f747127505e08b51af3e50d454b/reinvent_hitl_scoring-0.0.11.tar.gz (from https://pypi.org/simple/reinvent-hitl-scoring/) (requires-python:>=3.7), version: 0.0.11 2024-09-27T18:47:38,313 Found link https://files.pythonhosted.org/packages/c3/de/0578e160740426f1628a4ba9b00f282105202cd8240cb2862db0d5f0e70a/reinvent_hitl_scoring-0.0.12.tar.gz (from https://pypi.org/simple/reinvent-hitl-scoring/) (requires-python:>=3.7), version: 0.0.12 2024-09-27T18:47:38,314 Found link https://files.pythonhosted.org/packages/24/71/0fed7133c3ca14a64143c2beaa23c77005b24339424a4d54627e7a4351f1/reinvent_hitl_scoring-0.0.13.tar.gz (from https://pypi.org/simple/reinvent-hitl-scoring/) (requires-python:>=3.7), version: 0.0.13 2024-09-27T18:47:38,315 Found link https://files.pythonhosted.org/packages/06/3d/2bbba7e3793c11f5b1189229203b7141c72a23b58c00bfe9df3d97ec49b5/reinvent_hitl_scoring-0.0.14.tar.gz (from https://pypi.org/simple/reinvent-hitl-scoring/) (requires-python:>=3.7), version: 0.0.14 2024-09-27T18:47:38,316 Fetching project page and analyzing links: https://www.piwheels.org/simple/reinvent-hitl-scoring/ 2024-09-27T18:47:38,316 Getting page https://www.piwheels.org/simple/reinvent-hitl-scoring/ 2024-09-27T18:47:38,318 Found index url https://www.piwheels.org/simple/ 2024-09-27T18:47:38,487 Fetched page https://www.piwheels.org/simple/reinvent-hitl-scoring/ as text/html 2024-09-27T18:47:38,490 Skipping link: No binaries permitted for reinvent-hitl-scoring: https://www.piwheels.org/simple/reinvent-hitl-scoring/reinvent_hitl_scoring-0.0.13-py3-none-any.whl#sha256=97f60746966c244b015691affdb3f67667265817dbee7197801520078ac7a848 (from https://www.piwheels.org/simple/reinvent-hitl-scoring/) (requires-python:>=3.7) 2024-09-27T18:47:38,491 Skipping link: No binaries permitted for reinvent-hitl-scoring: https://www.piwheels.org/simple/reinvent-hitl-scoring/reinvent_hitl_scoring-0.0.12-py3-none-any.whl#sha256=e8743deba97eca2b44ee90352969c7715f7ee98a4686db2392ba2992b604cc7a (from https://www.piwheels.org/simple/reinvent-hitl-scoring/) (requires-python:>=3.7) 2024-09-27T18:47:38,491 Skipping link: No binaries permitted for reinvent-hitl-scoring: https://www.piwheels.org/simple/reinvent-hitl-scoring/reinvent_hitl_scoring-0.0.11-py3-none-any.whl#sha256=8f44b1bbe58911bf4e20ff8e036704639a87f86370163f1dd9a8f68dcd589476 (from https://www.piwheels.org/simple/reinvent-hitl-scoring/) (requires-python:>=3.7) 2024-09-27T18:47:38,492 Skipping link: No binaries permitted for reinvent-hitl-scoring: https://www.piwheels.org/simple/reinvent-hitl-scoring/reinvent_hitl_scoring-0.0.10-py3-none-any.whl#sha256=30e83a16b32aa93b2e99b0c38018d3068f56202db07923d2fa20506b167905ba (from https://www.piwheels.org/simple/reinvent-hitl-scoring/) (requires-python:>=3.7) 2024-09-27T18:47:38,492 Skipping link: No binaries permitted for reinvent-hitl-scoring: https://www.piwheels.org/simple/reinvent-hitl-scoring/reinvent_hitl_scoring-0.0.9-py3-none-any.whl#sha256=3a16313d85501bf5c56669a19effacf3512d332aefdde22dc4cbb0d73442a443 (from https://www.piwheels.org/simple/reinvent-hitl-scoring/) (requires-python:>=3.7) 2024-09-27T18:47:38,493 Skipping link: No binaries permitted for reinvent-hitl-scoring: https://www.piwheels.org/simple/reinvent-hitl-scoring/reinvent_hitl_scoring-0.0.8-py3-none-any.whl#sha256=744ba4ab9d5720f94f9bf60261af5383eff9703f025857823838177507cb530b (from https://www.piwheels.org/simple/reinvent-hitl-scoring/) (requires-python:>=3.7) 2024-09-27T18:47:38,493 Skipping link: No binaries permitted for reinvent-hitl-scoring: https://www.piwheels.org/simple/reinvent-hitl-scoring/reinvent_hitl_scoring-0.0.7-py3-none-any.whl#sha256=8fe3c43e0d795f6b6ee8f3961ce24662802028c9b7cc8d1cd915dca9b2287a15 (from https://www.piwheels.org/simple/reinvent-hitl-scoring/) (requires-python:>=3.7) 2024-09-27T18:47:38,494 Skipping link: No binaries permitted for reinvent-hitl-scoring: https://www.piwheels.org/simple/reinvent-hitl-scoring/reinvent_hitl_scoring-0.0.6-py3-none-any.whl#sha256=0f379b389c6fb6a5dff8f27b33b2b4742f8a3b6de4d1478315c75656b244d5db (from https://www.piwheels.org/simple/reinvent-hitl-scoring/) (requires-python:>=3.7) 2024-09-27T18:47:38,494 Skipping link: not a file: https://www.piwheels.org/simple/reinvent-hitl-scoring/ 2024-09-27T18:47:38,495 Skipping link: not a file: https://pypi.org/simple/reinvent-hitl-scoring/ 2024-09-27T18:47:38,515 Given no hashes to check 1 links for project 'reinvent-hitl-scoring': discarding no candidates 2024-09-27T18:47:38,517 Collecting reinvent-hitl-scoring==0.0.14 2024-09-27T18:47:38,519 Created temporary directory: /tmp/pip-unpack-7_kulkgo 2024-09-27T18:47:38,742 Downloading reinvent_hitl_scoring-0.0.14.tar.gz (3.9 MB) 2024-09-27T18:47:39,859 Added reinvent-hitl-scoring==0.0.14 from https://files.pythonhosted.org/packages/06/3d/2bbba7e3793c11f5b1189229203b7141c72a23b58c00bfe9df3d97ec49b5/reinvent_hitl_scoring-0.0.14.tar.gz to build tracker '/tmp/pip-build-tracker-lp7qc5ch' 2024-09-27T18:47:39,863 Running setup.py (path:/tmp/pip-wheel-_owa3ouj/reinvent-hitl-scoring_00bdbf6492824ad38c853cc62e1d4e55/setup.py) egg_info for package reinvent-hitl-scoring 2024-09-27T18:47:39,864 Created temporary directory: /tmp/pip-pip-egg-info-l03r3ui_ 2024-09-27T18:47:39,864 Preparing metadata (setup.py): started 2024-09-27T18:47:39,866 Running command python setup.py egg_info 2024-09-27T18:47:41,063 running egg_info 2024-09-27T18:47:41,065 creating /tmp/pip-pip-egg-info-l03r3ui_/reinvent_hitl_scoring.egg-info 2024-09-27T18:47:41,091 writing /tmp/pip-pip-egg-info-l03r3ui_/reinvent_hitl_scoring.egg-info/PKG-INFO 2024-09-27T18:47:41,094 writing dependency_links to /tmp/pip-pip-egg-info-l03r3ui_/reinvent_hitl_scoring.egg-info/dependency_links.txt 2024-09-27T18:47:41,096 writing top-level names to /tmp/pip-pip-egg-info-l03r3ui_/reinvent_hitl_scoring.egg-info/top_level.txt 2024-09-27T18:47:41,097 writing manifest file '/tmp/pip-pip-egg-info-l03r3ui_/reinvent_hitl_scoring.egg-info/SOURCES.txt' 2024-09-27T18:47:41,210 reading manifest file '/tmp/pip-pip-egg-info-l03r3ui_/reinvent_hitl_scoring.egg-info/SOURCES.txt' 2024-09-27T18:47:41,218 writing manifest file '/tmp/pip-pip-egg-info-l03r3ui_/reinvent_hitl_scoring.egg-info/SOURCES.txt' 2024-09-27T18:47:41,328 Preparing metadata (setup.py): finished with status 'done' 2024-09-27T18:47:41,331 Source in /tmp/pip-wheel-_owa3ouj/reinvent-hitl-scoring_00bdbf6492824ad38c853cc62e1d4e55 has version 0.0.14, which satisfies requirement reinvent-hitl-scoring==0.0.14 from https://files.pythonhosted.org/packages/06/3d/2bbba7e3793c11f5b1189229203b7141c72a23b58c00bfe9df3d97ec49b5/reinvent_hitl_scoring-0.0.14.tar.gz 2024-09-27T18:47:41,332 Removed reinvent-hitl-scoring==0.0.14 from https://files.pythonhosted.org/packages/06/3d/2bbba7e3793c11f5b1189229203b7141c72a23b58c00bfe9df3d97ec49b5/reinvent_hitl_scoring-0.0.14.tar.gz from build tracker '/tmp/pip-build-tracker-lp7qc5ch' 2024-09-27T18:47:41,337 Created temporary directory: /tmp/pip-unpack-elxqwt8c 2024-09-27T18:47:41,338 Created temporary directory: /tmp/pip-unpack-tfo37d0y 2024-09-27T18:47:41,339 Building wheels for collected packages: reinvent-hitl-scoring 2024-09-27T18:47:41,343 Created temporary directory: /tmp/pip-wheel-6l80najh 2024-09-27T18:47:41,343 Building wheel for reinvent-hitl-scoring (setup.py): started 2024-09-27T18:47:41,344 Destination directory: /tmp/pip-wheel-6l80najh 2024-09-27T18:47:41,345 Running command python setup.py bdist_wheel 2024-09-27T18:47:42,370 running bdist_wheel 2024-09-27T18:47:42,500 running build 2024-09-27T18:47:42,501 running build_py 2024-09-27T18:47:42,533 creating build/lib/reinvent_hitl_scoring 2024-09-27T18:47:42,535 copying reinvent_hitl_scoring/__init__.py -> build/lib/reinvent_hitl_scoring 2024-09-27T18:47:42,538 creating build/lib/reinvent_hitl_scoring/scoring 2024-09-27T18:47:42,539 copying reinvent_hitl_scoring/scoring/scoring_function_factory.py -> build/lib/reinvent_hitl_scoring/scoring 2024-09-27T18:47:42,541 copying reinvent_hitl_scoring/scoring/__init__.py -> build/lib/reinvent_hitl_scoring/scoring 2024-09-27T18:47:42,543 copying reinvent_hitl_scoring/scoring/score_summary.py -> build/lib/reinvent_hitl_scoring/scoring 2024-09-27T18:47:42,545 copying reinvent_hitl_scoring/scoring/utils.py -> build/lib/reinvent_hitl_scoring/scoring 2024-09-27T18:47:42,547 copying reinvent_hitl_scoring/scoring/component_parameters.py -> build/lib/reinvent_hitl_scoring/scoring 2024-09-27T18:47:42,549 copying reinvent_hitl_scoring/scoring/scoring_function_parameters.py -> build/lib/reinvent_hitl_scoring/scoring 2024-09-27T18:47:42,551 copying reinvent_hitl_scoring/scoring/score_transformations.py -> build/lib/reinvent_hitl_scoring/scoring 2024-09-27T18:47:42,554 creating build/lib/reinvent_hitl_scoring/configs 2024-09-27T18:47:42,555 copying reinvent_hitl_scoring/configs/__init__.py -> build/lib/reinvent_hitl_scoring/configs 2024-09-27T18:47:42,557 copying reinvent_hitl_scoring/configs/config.py -> build/lib/reinvent_hitl_scoring/configs 2024-09-27T18:47:42,559 creating build/lib/reinvent_hitl_scoring/scoring/score_components 2024-09-27T18:47:42,560 copying reinvent_hitl_scoring/scoring/score_components/score_component_factory.py -> build/lib/reinvent_hitl_scoring/scoring/score_components 2024-09-27T18:47:42,563 copying reinvent_hitl_scoring/scoring/score_components/base_score_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components 2024-09-27T18:47:42,565 copying reinvent_hitl_scoring/scoring/score_components/__init__.py -> build/lib/reinvent_hitl_scoring/scoring/score_components 2024-09-27T18:47:42,567 creating build/lib/reinvent_hitl_scoring/scoring/predictive_model 2024-09-27T18:47:42,568 copying reinvent_hitl_scoring/scoring/predictive_model/scikit_model_container.py -> build/lib/reinvent_hitl_scoring/scoring/predictive_model 2024-09-27T18:47:42,570 copying reinvent_hitl_scoring/scoring/predictive_model/model_container.py -> build/lib/reinvent_hitl_scoring/scoring/predictive_model 2024-09-27T18:47:42,572 copying reinvent_hitl_scoring/scoring/predictive_model/stan_model_container.py -> build/lib/reinvent_hitl_scoring/scoring/predictive_model 2024-09-27T18:47:42,574 copying reinvent_hitl_scoring/scoring/predictive_model/__init__.py -> build/lib/reinvent_hitl_scoring/scoring/predictive_model 2024-09-27T18:47:42,576 copying reinvent_hitl_scoring/scoring/predictive_model/base_model_container.py -> build/lib/reinvent_hitl_scoring/scoring/predictive_model 2024-09-27T18:47:42,577 copying reinvent_hitl_scoring/scoring/predictive_model/optuna_container.py -> build/lib/reinvent_hitl_scoring/scoring/predictive_model 2024-09-27T18:47:42,579 copying reinvent_hitl_scoring/scoring/predictive_model/torch_model_container.py -> build/lib/reinvent_hitl_scoring/scoring/predictive_model 2024-09-27T18:47:42,582 creating build/lib/reinvent_hitl_scoring/scoring/diversity_filters 2024-09-27T18:47:42,583 copying reinvent_hitl_scoring/scoring/diversity_filters/__init__.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters 2024-09-27T18:47:42,585 creating build/lib/reinvent_hitl_scoring/scoring/function 2024-09-27T18:47:42,586 copying reinvent_hitl_scoring/scoring/function/custom_sum.py -> build/lib/reinvent_hitl_scoring/scoring/function 2024-09-27T18:47:42,588 copying reinvent_hitl_scoring/scoring/function/custom_product.py -> build/lib/reinvent_hitl_scoring/scoring/function 2024-09-27T18:47:42,590 copying reinvent_hitl_scoring/scoring/function/__init__.py -> build/lib/reinvent_hitl_scoring/scoring/function 2024-09-27T18:47:42,592 copying reinvent_hitl_scoring/scoring/function/base_scoring_function.py -> build/lib/reinvent_hitl_scoring/scoring/function 2024-09-27T18:47:42,595 creating build/lib/reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:42,596 copying reinvent_hitl_scoring/scoring/enums/component_specific_parameters_enum.py -> build/lib/reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:42,598 copying reinvent_hitl_scoring/scoring/enums/transformation_type_enum.py -> build/lib/reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:42,600 copying reinvent_hitl_scoring/scoring/enums/__init__.py -> build/lib/reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:42,602 copying reinvent_hitl_scoring/scoring/enums/descriptor_types_enum.py -> build/lib/reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:42,604 copying reinvent_hitl_scoring/scoring/enums/transformation_parameters_enum.py -> build/lib/reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:42,606 copying reinvent_hitl_scoring/scoring/enums/rocs_specific_parameters_enum.py -> build/lib/reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:42,607 copying reinvent_hitl_scoring/scoring/enums/rocs_input_file_types_enum.py -> build/lib/reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:42,609 copying reinvent_hitl_scoring/scoring/enums/environmental_variables_enum.py -> build/lib/reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:42,611 copying reinvent_hitl_scoring/scoring/enums/logging_mode_enum.py -> build/lib/reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:42,612 copying reinvent_hitl_scoring/scoring/enums/container_type_enum.py -> build/lib/reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:42,614 copying reinvent_hitl_scoring/scoring/enums/scoring_function_component_enum.py -> build/lib/reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:42,616 copying reinvent_hitl_scoring/scoring/enums/scoring_function_enum.py -> build/lib/reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:42,618 copying reinvent_hitl_scoring/scoring/enums/diversity_filter_enum.py -> build/lib/reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:42,620 copying reinvent_hitl_scoring/scoring/enums/rocs_similarity_measures_enum.py -> build/lib/reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:42,622 creating build/lib/reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:42,623 copying reinvent_hitl_scoring/scoring/score_components/physchem/graph_length.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:42,625 copying reinvent_hitl_scoring/scoring/score_components/physchem/number_of_stereo_centers.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:42,627 copying reinvent_hitl_scoring/scoring/score_components/physchem/rot_bonds.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:42,629 copying reinvent_hitl_scoring/scoring/score_components/physchem/num_rings.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:42,631 copying reinvent_hitl_scoring/scoring/score_components/physchem/num_aliphatic_rings.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:42,632 copying reinvent_hitl_scoring/scoring/score_components/physchem/base_physchem_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:42,634 copying reinvent_hitl_scoring/scoring/score_components/physchem/hba.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:42,636 copying reinvent_hitl_scoring/scoring/score_components/physchem/__init__.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:42,638 copying reinvent_hitl_scoring/scoring/score_components/physchem/mol_weight.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:42,640 copying reinvent_hitl_scoring/scoring/score_components/physchem/tpsa.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:42,642 copying reinvent_hitl_scoring/scoring/score_components/physchem/hbd.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:42,644 copying reinvent_hitl_scoring/scoring/score_components/physchem/slogp.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:42,645 copying reinvent_hitl_scoring/scoring/score_components/physchem/num_aromatic_rings.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:42,648 creating build/lib/reinvent_hitl_scoring/scoring/score_components/rest 2024-09-27T18:47:42,649 copying reinvent_hitl_scoring/scoring/score_components/rest/__init__.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/rest 2024-09-27T18:47:42,651 copying reinvent_hitl_scoring/scoring/score_components/rest/general_rest_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/rest 2024-09-27T18:47:42,653 creating build/lib/reinvent_hitl_scoring/scoring/score_components/structural 2024-09-27T18:47:42,655 copying reinvent_hitl_scoring/scoring/score_components/structural/__init__.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/structural 2024-09-27T18:47:42,657 copying reinvent_hitl_scoring/scoring/score_components/structural/base_structural_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/structural 2024-09-27T18:47:42,658 copying reinvent_hitl_scoring/scoring/score_components/structural/azdock.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/structural 2024-09-27T18:47:42,660 copying reinvent_hitl_scoring/scoring/score_components/structural/dockstream.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/structural 2024-09-27T18:47:42,663 creating build/lib/reinvent_hitl_scoring/scoring/score_components/aizynth 2024-09-27T18:47:42,664 copying reinvent_hitl_scoring/scoring/score_components/aizynth/__init__.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/aizynth 2024-09-27T18:47:42,666 copying reinvent_hitl_scoring/scoring/score_components/aizynth/building_block_availability_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/aizynth 2024-09-27T18:47:42,668 creating build/lib/reinvent_hitl_scoring/scoring/score_components/rocs 2024-09-27T18:47:42,669 copying reinvent_hitl_scoring/scoring/score_components/rocs/parallel_rocs_similarity.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/rocs 2024-09-27T18:47:42,672 copying reinvent_hitl_scoring/scoring/score_components/rocs/default_values.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/rocs 2024-09-27T18:47:42,673 copying reinvent_hitl_scoring/scoring/score_components/rocs/base_rocs_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/rocs 2024-09-27T18:47:42,675 copying reinvent_hitl_scoring/scoring/score_components/rocs/__init__.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/rocs 2024-09-27T18:47:42,677 copying reinvent_hitl_scoring/scoring/score_components/rocs/rocs_similarity.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/rocs 2024-09-27T18:47:42,679 copying reinvent_hitl_scoring/scoring/score_components/rocs/oehelper.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/rocs 2024-09-27T18:47:42,681 copying reinvent_hitl_scoring/scoring/score_components/rocs/oefuncs.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/rocs 2024-09-27T18:47:42,683 creating build/lib/reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:42,684 copying reinvent_hitl_scoring/scoring/score_components/standard/chemprop_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:42,687 copying reinvent_hitl_scoring/scoring/score_components/standard/tanimoto_similarity.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:42,689 copying reinvent_hitl_scoring/scoring/score_components/standard/predictive_property_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:42,691 copying reinvent_hitl_scoring/scoring/score_components/standard/qed_score.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:42,693 copying reinvent_hitl_scoring/scoring/score_components/standard/__init__.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:42,695 copying reinvent_hitl_scoring/scoring/score_components/standard/custom_alerts_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:42,697 copying reinvent_hitl_scoring/scoring/score_components/standard/selectivity_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:42,699 copying reinvent_hitl_scoring/scoring/score_components/standard/jaccard_distance.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:42,701 copying reinvent_hitl_scoring/scoring/score_components/standard/matching_substructure.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:42,703 creating build/lib/reinvent_hitl_scoring/scoring/score_components/console_invoked 2024-09-27T18:47:42,704 copying reinvent_hitl_scoring/scoring/score_components/console_invoked/base_console_invoked_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/console_invoked 2024-09-27T18:47:42,706 copying reinvent_hitl_scoring/scoring/score_components/console_invoked/icolos.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/console_invoked 2024-09-27T18:47:42,709 copying reinvent_hitl_scoring/scoring/score_components/console_invoked/__init__.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/console_invoked 2024-09-27T18:47:42,711 creating build/lib/reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility 2024-09-27T18:47:42,712 copying reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility/sascorer.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility 2024-09-27T18:47:42,715 copying reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility/__init__.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility 2024-09-27T18:47:42,716 copying reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility/sas_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility 2024-09-27T18:47:42,719 creating build/lib/reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:42,720 copying reinvent_hitl_scoring/scoring/score_components/pip/base_pip_model_batching_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:42,723 copying reinvent_hitl_scoring/scoring/score_components/pip/qptuna_pip_model_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:42,724 copying reinvent_hitl_scoring/scoring/score_components/pip/base_pip_model_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:42,726 copying reinvent_hitl_scoring/scoring/score_components/pip/__init__.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:42,728 copying reinvent_hitl_scoring/scoring/score_components/pip/base_rest_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:42,730 copying reinvent_hitl_scoring/scoring/score_components/pip/string_pip_prediction_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:42,732 copying reinvent_hitl_scoring/scoring/score_components/pip/pip_log_prediction_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:42,734 copying reinvent_hitl_scoring/scoring/score_components/pip/ratpk_pip.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:42,736 copying reinvent_hitl_scoring/scoring/score_components/pip/pip_prediction_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:42,739 creating build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:42,740 copying reinvent_hitl_scoring/scoring/score_components/link_invent/base_link_invent_component.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:42,742 copying reinvent_hitl_scoring/scoring/score_components/link_invent/linker_mol_weight.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:42,744 copying reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_sp2_atoms.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:42,746 copying reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_aromatic_rings.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:42,748 copying reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_hbd.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:42,750 copying reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_sp_atoms.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:42,752 copying reinvent_hitl_scoring/scoring/score_components/link_invent/linker_graph_length.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:42,754 copying reinvent_hitl_scoring/scoring/score_components/link_invent/__init__.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:42,756 copying reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_rings.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:42,757 copying reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_hba.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:42,759 copying reinvent_hitl_scoring/scoring/score_components/link_invent/linker_length_ratio.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:42,761 copying reinvent_hitl_scoring/scoring/score_components/link_invent/linker_ratio_rotatable_bonds.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:42,762 copying reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_sp3_atoms.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:42,764 copying reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_aliphatic_rings.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:42,766 copying reinvent_hitl_scoring/scoring/score_components/link_invent/linker_effective_length.py -> build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:42,768 creating build/lib/reinvent_hitl_scoring/scoring/diversity_filters/lib_invent 2024-09-27T18:47:42,769 copying reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/no_filter_with_penalty.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/lib_invent 2024-09-27T18:47:42,772 copying reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/__init__.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/lib_invent 2024-09-27T18:47:42,773 copying reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/diversity_filter_parameters.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/lib_invent 2024-09-27T18:47:42,775 copying reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/diversity_filter_memory.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/lib_invent 2024-09-27T18:47:42,777 copying reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/no_filter.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/lib_invent 2024-09-27T18:47:42,779 copying reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/base_diversity_filter.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/lib_invent 2024-09-27T18:47:42,781 copying reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/diversity_filter.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/lib_invent 2024-09-27T18:47:42,782 copying reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/identical_murcko_scaffold.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/lib_invent 2024-09-27T18:47:42,785 creating build/lib/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:42,786 copying reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/scaffold_similarity.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:42,789 copying reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/__init__.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:42,790 copying reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/diversity_filter_parameters.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:42,792 copying reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/diversity_filter_memory.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:42,794 copying reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/no_scaffold_filter.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:42,797 copying reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/identical_topological_scaffold.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:42,799 copying reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/base_diversity_filter.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:42,801 copying reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/diversity_filter.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:42,802 copying reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/identical_murcko_scaffold.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:42,805 creating build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:42,806 copying reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/scaffold_similarity.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:42,809 copying reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/no_filter_with_penalty.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:42,811 copying reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/loggable_data_dto.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:42,813 copying reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/__init__.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:42,814 copying reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/diversity_filter_parameters.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:42,816 copying reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/column_names_enum.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:42,818 copying reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/diversity_filter_memory.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:42,820 copying reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/update_diversity_filter_dto.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:42,822 copying reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/no_filter.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:42,824 copying reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/identical_topological_scaffold.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:42,826 copying reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/base_diversity_filter.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:42,827 copying reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/diversity_filter.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:42,829 copying reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/memory_record_dto.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:42,831 copying reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/identical_murcko_scaffold.py -> build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:42,842 copying reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility/fpscores.pkl.gz -> build/lib/reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility 2024-09-27T18:47:42,934 /usr/local/lib/python3.11/dist-packages/setuptools/_distutils/cmd.py:66: SetuptoolsDeprecationWarning: setup.py install is deprecated. 2024-09-27T18:47:42,935 !! 2024-09-27T18:47:42,936 ******************************************************************************** 2024-09-27T18:47:42,936 Please avoid running ``setup.py`` directly. 2024-09-27T18:47:42,937 Instead, use pypa/build, pypa/installer or other 2024-09-27T18:47:42,937 standards-based tools. 2024-09-27T18:47:42,938 See https://blog.ganssle.io/articles/2021/10/setup-py-deprecated.html for details. 2024-09-27T18:47:42,939 ******************************************************************************** 2024-09-27T18:47:42,940 !! 2024-09-27T18:47:42,940 self.initialize_options() 2024-09-27T18:47:42,963 installing to build/bdist.linux-armv7l/wheel 2024-09-27T18:47:42,963 running install 2024-09-27T18:47:42,988 running install_lib 2024-09-27T18:47:43,015 creating build/bdist.linux-armv7l/wheel 2024-09-27T18:47:43,017 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring 2024-09-27T18:47:43,019 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/scoring 2024-09-27T18:47:43,020 copying build/lib/reinvent_hitl_scoring/scoring/scoring_function_factory.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring 2024-09-27T18:47:43,022 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/scoring/score_components 2024-09-27T18:47:43,024 copying build/lib/reinvent_hitl_scoring/scoring/score_components/score_component_factory.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components 2024-09-27T18:47:43,026 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:43,028 copying build/lib/reinvent_hitl_scoring/scoring/score_components/physchem/graph_length.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:43,030 copying build/lib/reinvent_hitl_scoring/scoring/score_components/physchem/number_of_stereo_centers.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:43,031 copying build/lib/reinvent_hitl_scoring/scoring/score_components/physchem/rot_bonds.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:43,033 copying build/lib/reinvent_hitl_scoring/scoring/score_components/physchem/num_rings.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:43,035 copying build/lib/reinvent_hitl_scoring/scoring/score_components/physchem/num_aliphatic_rings.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:43,037 copying build/lib/reinvent_hitl_scoring/scoring/score_components/physchem/base_physchem_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:43,039 copying build/lib/reinvent_hitl_scoring/scoring/score_components/physchem/hba.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:43,040 copying build/lib/reinvent_hitl_scoring/scoring/score_components/physchem/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:43,042 copying build/lib/reinvent_hitl_scoring/scoring/score_components/physchem/mol_weight.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:43,044 copying build/lib/reinvent_hitl_scoring/scoring/score_components/physchem/tpsa.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:43,045 copying build/lib/reinvent_hitl_scoring/scoring/score_components/physchem/hbd.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:43,047 copying build/lib/reinvent_hitl_scoring/scoring/score_components/physchem/slogp.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:43,049 copying build/lib/reinvent_hitl_scoring/scoring/score_components/physchem/num_aromatic_rings.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/physchem 2024-09-27T18:47:43,051 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/scoring/score_components/rest 2024-09-27T18:47:43,052 copying build/lib/reinvent_hitl_scoring/scoring/score_components/rest/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/rest 2024-09-27T18:47:43,054 copying build/lib/reinvent_hitl_scoring/scoring/score_components/rest/general_rest_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/rest 2024-09-27T18:47:43,056 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/scoring/score_components/structural 2024-09-27T18:47:43,057 copying build/lib/reinvent_hitl_scoring/scoring/score_components/structural/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/structural 2024-09-27T18:47:43,059 copying build/lib/reinvent_hitl_scoring/scoring/score_components/structural/base_structural_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/structural 2024-09-27T18:47:43,061 copying build/lib/reinvent_hitl_scoring/scoring/score_components/structural/azdock.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/structural 2024-09-27T18:47:43,063 copying build/lib/reinvent_hitl_scoring/scoring/score_components/structural/dockstream.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/structural 2024-09-27T18:47:43,065 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/scoring/score_components/aizynth 2024-09-27T18:47:43,067 copying build/lib/reinvent_hitl_scoring/scoring/score_components/aizynth/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/aizynth 2024-09-27T18:47:43,069 copying build/lib/reinvent_hitl_scoring/scoring/score_components/aizynth/building_block_availability_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/aizynth 2024-09-27T18:47:43,071 copying build/lib/reinvent_hitl_scoring/scoring/score_components/base_score_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components 2024-09-27T18:47:43,072 copying build/lib/reinvent_hitl_scoring/scoring/score_components/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components 2024-09-27T18:47:43,075 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/scoring/score_components/rocs 2024-09-27T18:47:43,076 copying build/lib/reinvent_hitl_scoring/scoring/score_components/rocs/parallel_rocs_similarity.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/rocs 2024-09-27T18:47:43,078 copying build/lib/reinvent_hitl_scoring/scoring/score_components/rocs/default_values.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/rocs 2024-09-27T18:47:43,080 copying build/lib/reinvent_hitl_scoring/scoring/score_components/rocs/base_rocs_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/rocs 2024-09-27T18:47:43,082 copying build/lib/reinvent_hitl_scoring/scoring/score_components/rocs/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/rocs 2024-09-27T18:47:43,084 copying build/lib/reinvent_hitl_scoring/scoring/score_components/rocs/rocs_similarity.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/rocs 2024-09-27T18:47:43,086 copying build/lib/reinvent_hitl_scoring/scoring/score_components/rocs/oehelper.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/rocs 2024-09-27T18:47:43,088 copying build/lib/reinvent_hitl_scoring/scoring/score_components/rocs/oefuncs.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/rocs 2024-09-27T18:47:43,091 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:43,092 copying build/lib/reinvent_hitl_scoring/scoring/score_components/standard/chemprop_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:43,094 copying build/lib/reinvent_hitl_scoring/scoring/score_components/standard/tanimoto_similarity.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:43,096 copying build/lib/reinvent_hitl_scoring/scoring/score_components/standard/predictive_property_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:43,098 copying build/lib/reinvent_hitl_scoring/scoring/score_components/standard/qed_score.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:43,100 copying build/lib/reinvent_hitl_scoring/scoring/score_components/standard/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:43,101 copying build/lib/reinvent_hitl_scoring/scoring/score_components/standard/custom_alerts_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:43,103 copying build/lib/reinvent_hitl_scoring/scoring/score_components/standard/selectivity_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:43,106 copying build/lib/reinvent_hitl_scoring/scoring/score_components/standard/jaccard_distance.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:43,108 copying build/lib/reinvent_hitl_scoring/scoring/score_components/standard/matching_substructure.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/standard 2024-09-27T18:47:43,110 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/scoring/score_components/console_invoked 2024-09-27T18:47:43,111 copying build/lib/reinvent_hitl_scoring/scoring/score_components/console_invoked/base_console_invoked_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/console_invoked 2024-09-27T18:47:43,113 copying build/lib/reinvent_hitl_scoring/scoring/score_components/console_invoked/icolos.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/console_invoked 2024-09-27T18:47:43,115 copying build/lib/reinvent_hitl_scoring/scoring/score_components/console_invoked/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/console_invoked 2024-09-27T18:47:43,118 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility 2024-09-27T18:47:43,119 copying build/lib/reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility/sascorer.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility 2024-09-27T18:47:43,121 copying build/lib/reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility 2024-09-27T18:47:43,123 copying build/lib/reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility/fpscores.pkl.gz -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility 2024-09-27T18:47:43,182 copying build/lib/reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility/sas_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility 2024-09-27T18:47:43,185 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:43,186 copying build/lib/reinvent_hitl_scoring/scoring/score_components/pip/base_pip_model_batching_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:43,189 copying build/lib/reinvent_hitl_scoring/scoring/score_components/pip/qptuna_pip_model_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:43,191 copying build/lib/reinvent_hitl_scoring/scoring/score_components/pip/base_pip_model_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:43,193 copying build/lib/reinvent_hitl_scoring/scoring/score_components/pip/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:43,194 copying build/lib/reinvent_hitl_scoring/scoring/score_components/pip/base_rest_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:43,197 copying build/lib/reinvent_hitl_scoring/scoring/score_components/pip/string_pip_prediction_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:43,199 copying build/lib/reinvent_hitl_scoring/scoring/score_components/pip/pip_log_prediction_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:43,201 copying build/lib/reinvent_hitl_scoring/scoring/score_components/pip/ratpk_pip.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:43,202 copying build/lib/reinvent_hitl_scoring/scoring/score_components/pip/pip_prediction_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/pip 2024-09-27T18:47:43,205 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:43,207 copying build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent/base_link_invent_component.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:43,209 copying build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent/linker_mol_weight.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:43,211 copying build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_sp2_atoms.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:43,213 copying build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_aromatic_rings.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:43,215 copying build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_hbd.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:43,217 copying build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_sp_atoms.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:43,218 copying build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent/linker_graph_length.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:43,220 copying build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:43,222 copying build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_rings.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:43,224 copying build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_hba.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:43,227 copying build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent/linker_length_ratio.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:43,229 copying build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent/linker_ratio_rotatable_bonds.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:43,230 copying build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_sp3_atoms.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:43,232 copying build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_aliphatic_rings.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:43,234 copying build/lib/reinvent_hitl_scoring/scoring/score_components/link_invent/linker_effective_length.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/score_components/link_invent 2024-09-27T18:47:43,236 copying build/lib/reinvent_hitl_scoring/scoring/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring 2024-09-27T18:47:43,239 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/scoring/predictive_model 2024-09-27T18:47:43,240 copying build/lib/reinvent_hitl_scoring/scoring/predictive_model/scikit_model_container.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/predictive_model 2024-09-27T18:47:43,242 copying build/lib/reinvent_hitl_scoring/scoring/predictive_model/model_container.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/predictive_model 2024-09-27T18:47:43,244 copying build/lib/reinvent_hitl_scoring/scoring/predictive_model/stan_model_container.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/predictive_model 2024-09-27T18:47:43,247 copying build/lib/reinvent_hitl_scoring/scoring/predictive_model/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/predictive_model 2024-09-27T18:47:43,249 copying build/lib/reinvent_hitl_scoring/scoring/predictive_model/base_model_container.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/predictive_model 2024-09-27T18:47:43,250 copying build/lib/reinvent_hitl_scoring/scoring/predictive_model/optuna_container.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/predictive_model 2024-09-27T18:47:43,252 copying build/lib/reinvent_hitl_scoring/scoring/predictive_model/torch_model_container.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/predictive_model 2024-09-27T18:47:43,255 copying build/lib/reinvent_hitl_scoring/scoring/score_summary.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring 2024-09-27T18:47:43,257 copying build/lib/reinvent_hitl_scoring/scoring/utils.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring 2024-09-27T18:47:43,260 copying build/lib/reinvent_hitl_scoring/scoring/component_parameters.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring 2024-09-27T18:47:43,262 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/scoring/diversity_filters 2024-09-27T18:47:43,264 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters 2024-09-27T18:47:43,266 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/scoring/diversity_filters/lib_invent 2024-09-27T18:47:43,268 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/no_filter_with_penalty.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/lib_invent 2024-09-27T18:47:43,271 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/lib_invent 2024-09-27T18:47:43,273 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/diversity_filter_parameters.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/lib_invent 2024-09-27T18:47:43,275 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/diversity_filter_memory.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/lib_invent 2024-09-27T18:47:43,277 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/no_filter.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/lib_invent 2024-09-27T18:47:43,280 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/base_diversity_filter.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/lib_invent 2024-09-27T18:47:43,282 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/diversity_filter.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/lib_invent 2024-09-27T18:47:43,285 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/identical_murcko_scaffold.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/lib_invent 2024-09-27T18:47:43,288 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:43,289 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/scaffold_similarity.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:43,292 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:43,294 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/diversity_filter_parameters.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:43,296 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/diversity_filter_memory.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:43,298 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/no_scaffold_filter.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:43,300 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/identical_topological_scaffold.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:43,302 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/base_diversity_filter.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:43,304 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/diversity_filter.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:43,306 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/identical_murcko_scaffold.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core 2024-09-27T18:47:43,309 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:43,311 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/scaffold_similarity.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:43,314 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/no_filter_with_penalty.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:43,316 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/loggable_data_dto.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:43,317 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:43,319 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/diversity_filter_parameters.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:43,321 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/column_names_enum.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:43,322 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/diversity_filter_memory.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:43,324 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/update_diversity_filter_dto.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:43,326 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/no_filter.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:43,328 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/identical_topological_scaffold.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:43,330 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/base_diversity_filter.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:43,332 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/diversity_filter.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:43,333 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/memory_record_dto.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:43,335 copying build/lib/reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/identical_murcko_scaffold.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning 2024-09-27T18:47:43,337 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/scoring/function 2024-09-27T18:47:43,339 copying build/lib/reinvent_hitl_scoring/scoring/function/custom_sum.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/function 2024-09-27T18:47:43,341 copying build/lib/reinvent_hitl_scoring/scoring/function/custom_product.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/function 2024-09-27T18:47:43,342 copying build/lib/reinvent_hitl_scoring/scoring/function/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/function 2024-09-27T18:47:43,344 copying build/lib/reinvent_hitl_scoring/scoring/function/base_scoring_function.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/function 2024-09-27T18:47:43,348 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:43,349 copying build/lib/reinvent_hitl_scoring/scoring/enums/component_specific_parameters_enum.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:43,351 copying build/lib/reinvent_hitl_scoring/scoring/enums/transformation_type_enum.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:43,353 copying build/lib/reinvent_hitl_scoring/scoring/enums/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:43,354 copying build/lib/reinvent_hitl_scoring/scoring/enums/descriptor_types_enum.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:43,356 copying build/lib/reinvent_hitl_scoring/scoring/enums/transformation_parameters_enum.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:43,357 copying build/lib/reinvent_hitl_scoring/scoring/enums/rocs_specific_parameters_enum.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:43,359 copying build/lib/reinvent_hitl_scoring/scoring/enums/rocs_input_file_types_enum.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:43,361 copying build/lib/reinvent_hitl_scoring/scoring/enums/environmental_variables_enum.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:43,362 copying build/lib/reinvent_hitl_scoring/scoring/enums/logging_mode_enum.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:43,364 copying build/lib/reinvent_hitl_scoring/scoring/enums/container_type_enum.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:43,366 copying build/lib/reinvent_hitl_scoring/scoring/enums/scoring_function_component_enum.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:43,368 copying build/lib/reinvent_hitl_scoring/scoring/enums/scoring_function_enum.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:43,369 copying build/lib/reinvent_hitl_scoring/scoring/enums/diversity_filter_enum.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:43,371 copying build/lib/reinvent_hitl_scoring/scoring/enums/rocs_similarity_measures_enum.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring/enums 2024-09-27T18:47:43,373 copying build/lib/reinvent_hitl_scoring/scoring/scoring_function_parameters.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring 2024-09-27T18:47:43,374 copying build/lib/reinvent_hitl_scoring/scoring/score_transformations.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/scoring 2024-09-27T18:47:43,377 copying build/lib/reinvent_hitl_scoring/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring 2024-09-27T18:47:43,379 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring/configs 2024-09-27T18:47:43,380 copying build/lib/reinvent_hitl_scoring/configs/__init__.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/configs 2024-09-27T18:47:43,382 copying build/lib/reinvent_hitl_scoring/configs/config.py -> build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring/configs 2024-09-27T18:47:43,384 running install_egg_info 2024-09-27T18:47:43,420 running egg_info 2024-09-27T18:47:43,447 writing reinvent_hitl_scoring.egg-info/PKG-INFO 2024-09-27T18:47:43,449 writing dependency_links to reinvent_hitl_scoring.egg-info/dependency_links.txt 2024-09-27T18:47:43,451 writing top-level names to reinvent_hitl_scoring.egg-info/top_level.txt 2024-09-27T18:47:43,499 reading manifest file 'reinvent_hitl_scoring.egg-info/SOURCES.txt' 2024-09-27T18:47:43,517 writing manifest file 'reinvent_hitl_scoring.egg-info/SOURCES.txt' 2024-09-27T18:47:43,519 Copying reinvent_hitl_scoring.egg-info to build/bdist.linux-armv7l/wheel/./reinvent_hitl_scoring-0.0.14-py3.11.egg-info 2024-09-27T18:47:43,527 running install_scripts 2024-09-27T18:47:43,536 creating build/bdist.linux-armv7l/wheel/reinvent_hitl_scoring-0.0.14.dist-info/WHEEL 2024-09-27T18:47:43,539 creating '/tmp/pip-wheel-6l80najh/reinvent_hitl_scoring-0.0.14-py3-none-any.whl' and adding 'build/bdist.linux-armv7l/wheel' to it 2024-09-27T18:47:43,541 adding 'reinvent_hitl_scoring/__init__.py' 2024-09-27T18:47:43,542 adding 'reinvent_hitl_scoring/configs/__init__.py' 2024-09-27T18:47:43,544 adding 'reinvent_hitl_scoring/configs/config.py' 2024-09-27T18:47:43,545 adding 'reinvent_hitl_scoring/scoring/__init__.py' 2024-09-27T18:47:43,546 adding 'reinvent_hitl_scoring/scoring/component_parameters.py' 2024-09-27T18:47:43,548 adding 'reinvent_hitl_scoring/scoring/score_summary.py' 2024-09-27T18:47:43,549 adding 'reinvent_hitl_scoring/scoring/score_transformations.py' 2024-09-27T18:47:43,550 adding 'reinvent_hitl_scoring/scoring/scoring_function_factory.py' 2024-09-27T18:47:43,552 adding 'reinvent_hitl_scoring/scoring/scoring_function_parameters.py' 2024-09-27T18:47:43,553 adding 'reinvent_hitl_scoring/scoring/utils.py' 2024-09-27T18:47:43,554 adding 'reinvent_hitl_scoring/scoring/diversity_filters/__init__.py' 2024-09-27T18:47:43,556 adding 'reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/__init__.py' 2024-09-27T18:47:43,557 adding 'reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/base_diversity_filter.py' 2024-09-27T18:47:43,558 adding 'reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/column_names_enum.py' 2024-09-27T18:47:43,560 adding 'reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/diversity_filter.py' 2024-09-27T18:47:43,561 adding 'reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/diversity_filter_memory.py' 2024-09-27T18:47:43,562 adding 'reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/diversity_filter_parameters.py' 2024-09-27T18:47:43,564 adding 'reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/identical_murcko_scaffold.py' 2024-09-27T18:47:43,565 adding 'reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/identical_topological_scaffold.py' 2024-09-27T18:47:43,566 adding 'reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/loggable_data_dto.py' 2024-09-27T18:47:43,567 adding 'reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/memory_record_dto.py' 2024-09-27T18:47:43,568 adding 'reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/no_filter.py' 2024-09-27T18:47:43,570 adding 'reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/no_filter_with_penalty.py' 2024-09-27T18:47:43,571 adding 'reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/scaffold_similarity.py' 2024-09-27T18:47:43,572 adding 'reinvent_hitl_scoring/scoring/diversity_filters/curriculum_learning/update_diversity_filter_dto.py' 2024-09-27T18:47:43,574 adding 'reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/__init__.py' 2024-09-27T18:47:43,575 adding 'reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/base_diversity_filter.py' 2024-09-27T18:47:43,576 adding 'reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/diversity_filter.py' 2024-09-27T18:47:43,578 adding 'reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/diversity_filter_memory.py' 2024-09-27T18:47:43,579 adding 'reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/diversity_filter_parameters.py' 2024-09-27T18:47:43,580 adding 'reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/identical_murcko_scaffold.py' 2024-09-27T18:47:43,582 adding 'reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/no_filter.py' 2024-09-27T18:47:43,583 adding 'reinvent_hitl_scoring/scoring/diversity_filters/lib_invent/no_filter_with_penalty.py' 2024-09-27T18:47:43,585 adding 'reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/__init__.py' 2024-09-27T18:47:43,586 adding 'reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/base_diversity_filter.py' 2024-09-27T18:47:43,587 adding 'reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/diversity_filter.py' 2024-09-27T18:47:43,589 adding 'reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/diversity_filter_memory.py' 2024-09-27T18:47:43,590 adding 'reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/diversity_filter_parameters.py' 2024-09-27T18:47:43,591 adding 'reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/identical_murcko_scaffold.py' 2024-09-27T18:47:43,592 adding 'reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/identical_topological_scaffold.py' 2024-09-27T18:47:43,593 adding 'reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/no_scaffold_filter.py' 2024-09-27T18:47:43,595 adding 'reinvent_hitl_scoring/scoring/diversity_filters/reinvent_core/scaffold_similarity.py' 2024-09-27T18:47:43,596 adding 'reinvent_hitl_scoring/scoring/enums/__init__.py' 2024-09-27T18:47:43,598 adding 'reinvent_hitl_scoring/scoring/enums/component_specific_parameters_enum.py' 2024-09-27T18:47:43,599 adding 'reinvent_hitl_scoring/scoring/enums/container_type_enum.py' 2024-09-27T18:47:43,600 adding 'reinvent_hitl_scoring/scoring/enums/descriptor_types_enum.py' 2024-09-27T18:47:43,601 adding 'reinvent_hitl_scoring/scoring/enums/diversity_filter_enum.py' 2024-09-27T18:47:43,602 adding 'reinvent_hitl_scoring/scoring/enums/environmental_variables_enum.py' 2024-09-27T18:47:43,603 adding 'reinvent_hitl_scoring/scoring/enums/logging_mode_enum.py' 2024-09-27T18:47:43,605 adding 'reinvent_hitl_scoring/scoring/enums/rocs_input_file_types_enum.py' 2024-09-27T18:47:43,606 adding 'reinvent_hitl_scoring/scoring/enums/rocs_similarity_measures_enum.py' 2024-09-27T18:47:43,607 adding 'reinvent_hitl_scoring/scoring/enums/rocs_specific_parameters_enum.py' 2024-09-27T18:47:43,608 adding 'reinvent_hitl_scoring/scoring/enums/scoring_function_component_enum.py' 2024-09-27T18:47:43,610 adding 'reinvent_hitl_scoring/scoring/enums/scoring_function_enum.py' 2024-09-27T18:47:43,611 adding 'reinvent_hitl_scoring/scoring/enums/transformation_parameters_enum.py' 2024-09-27T18:47:43,612 adding 'reinvent_hitl_scoring/scoring/enums/transformation_type_enum.py' 2024-09-27T18:47:43,614 adding 'reinvent_hitl_scoring/scoring/function/__init__.py' 2024-09-27T18:47:43,615 adding 'reinvent_hitl_scoring/scoring/function/base_scoring_function.py' 2024-09-27T18:47:43,616 adding 'reinvent_hitl_scoring/scoring/function/custom_product.py' 2024-09-27T18:47:43,618 adding 'reinvent_hitl_scoring/scoring/function/custom_sum.py' 2024-09-27T18:47:43,619 adding 'reinvent_hitl_scoring/scoring/predictive_model/__init__.py' 2024-09-27T18:47:43,621 adding 'reinvent_hitl_scoring/scoring/predictive_model/base_model_container.py' 2024-09-27T18:47:43,622 adding 'reinvent_hitl_scoring/scoring/predictive_model/model_container.py' 2024-09-27T18:47:43,623 adding 'reinvent_hitl_scoring/scoring/predictive_model/optuna_container.py' 2024-09-27T18:47:43,624 adding 'reinvent_hitl_scoring/scoring/predictive_model/scikit_model_container.py' 2024-09-27T18:47:43,626 adding 'reinvent_hitl_scoring/scoring/predictive_model/stan_model_container.py' 2024-09-27T18:47:43,627 adding 'reinvent_hitl_scoring/scoring/predictive_model/torch_model_container.py' 2024-09-27T18:47:43,629 adding 'reinvent_hitl_scoring/scoring/score_components/__init__.py' 2024-09-27T18:47:43,631 adding 'reinvent_hitl_scoring/scoring/score_components/base_score_component.py' 2024-09-27T18:47:43,632 adding 'reinvent_hitl_scoring/scoring/score_components/score_component_factory.py' 2024-09-27T18:47:43,634 adding 'reinvent_hitl_scoring/scoring/score_components/aizynth/__init__.py' 2024-09-27T18:47:43,635 adding 'reinvent_hitl_scoring/scoring/score_components/aizynth/building_block_availability_component.py' 2024-09-27T18:47:43,637 adding 'reinvent_hitl_scoring/scoring/score_components/console_invoked/__init__.py' 2024-09-27T18:47:43,638 adding 'reinvent_hitl_scoring/scoring/score_components/console_invoked/base_console_invoked_component.py' 2024-09-27T18:47:43,640 adding 'reinvent_hitl_scoring/scoring/score_components/console_invoked/icolos.py' 2024-09-27T18:47:43,641 adding 'reinvent_hitl_scoring/scoring/score_components/link_invent/__init__.py' 2024-09-27T18:47:43,643 adding 'reinvent_hitl_scoring/scoring/score_components/link_invent/base_link_invent_component.py' 2024-09-27T18:47:43,644 adding 'reinvent_hitl_scoring/scoring/score_components/link_invent/linker_effective_length.py' 2024-09-27T18:47:43,645 adding 'reinvent_hitl_scoring/scoring/score_components/link_invent/linker_graph_length.py' 2024-09-27T18:47:43,646 adding 'reinvent_hitl_scoring/scoring/score_components/link_invent/linker_length_ratio.py' 2024-09-27T18:47:43,647 adding 'reinvent_hitl_scoring/scoring/score_components/link_invent/linker_mol_weight.py' 2024-09-27T18:47:43,648 adding 'reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_aliphatic_rings.py' 2024-09-27T18:47:43,649 adding 'reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_aromatic_rings.py' 2024-09-27T18:47:43,650 adding 'reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_hba.py' 2024-09-27T18:47:43,651 adding 'reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_hbd.py' 2024-09-27T18:47:43,653 adding 'reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_rings.py' 2024-09-27T18:47:43,654 adding 'reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_sp2_atoms.py' 2024-09-27T18:47:43,655 adding 'reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_sp3_atoms.py' 2024-09-27T18:47:43,656 adding 'reinvent_hitl_scoring/scoring/score_components/link_invent/linker_num_sp_atoms.py' 2024-09-27T18:47:43,657 adding 'reinvent_hitl_scoring/scoring/score_components/link_invent/linker_ratio_rotatable_bonds.py' 2024-09-27T18:47:43,659 adding 'reinvent_hitl_scoring/scoring/score_components/physchem/__init__.py' 2024-09-27T18:47:43,660 adding 'reinvent_hitl_scoring/scoring/score_components/physchem/base_physchem_component.py' 2024-09-27T18:47:43,661 adding 'reinvent_hitl_scoring/scoring/score_components/physchem/graph_length.py' 2024-09-27T18:47:43,662 adding 'reinvent_hitl_scoring/scoring/score_components/physchem/hba.py' 2024-09-27T18:47:43,663 adding 'reinvent_hitl_scoring/scoring/score_components/physchem/hbd.py' 2024-09-27T18:47:43,664 adding 'reinvent_hitl_scoring/scoring/score_components/physchem/mol_weight.py' 2024-09-27T18:47:43,665 adding 'reinvent_hitl_scoring/scoring/score_components/physchem/num_aliphatic_rings.py' 2024-09-27T18:47:43,667 adding 'reinvent_hitl_scoring/scoring/score_components/physchem/num_aromatic_rings.py' 2024-09-27T18:47:43,668 adding 'reinvent_hitl_scoring/scoring/score_components/physchem/num_rings.py' 2024-09-27T18:47:43,669 adding 'reinvent_hitl_scoring/scoring/score_components/physchem/number_of_stereo_centers.py' 2024-09-27T18:47:43,670 adding 'reinvent_hitl_scoring/scoring/score_components/physchem/rot_bonds.py' 2024-09-27T18:47:43,672 adding 'reinvent_hitl_scoring/scoring/score_components/physchem/slogp.py' 2024-09-27T18:47:43,673 adding 'reinvent_hitl_scoring/scoring/score_components/physchem/tpsa.py' 2024-09-27T18:47:43,674 adding 'reinvent_hitl_scoring/scoring/score_components/pip/__init__.py' 2024-09-27T18:47:43,676 adding 'reinvent_hitl_scoring/scoring/score_components/pip/base_pip_model_batching_component.py' 2024-09-27T18:47:43,677 adding 'reinvent_hitl_scoring/scoring/score_components/pip/base_pip_model_component.py' 2024-09-27T18:47:43,679 adding 'reinvent_hitl_scoring/scoring/score_components/pip/base_rest_component.py' 2024-09-27T18:47:43,680 adding 'reinvent_hitl_scoring/scoring/score_components/pip/pip_log_prediction_component.py' 2024-09-27T18:47:43,681 adding 'reinvent_hitl_scoring/scoring/score_components/pip/pip_prediction_component.py' 2024-09-27T18:47:43,682 adding 'reinvent_hitl_scoring/scoring/score_components/pip/qptuna_pip_model_component.py' 2024-09-27T18:47:43,683 adding 'reinvent_hitl_scoring/scoring/score_components/pip/ratpk_pip.py' 2024-09-27T18:47:43,685 adding 'reinvent_hitl_scoring/scoring/score_components/pip/string_pip_prediction_component.py' 2024-09-27T18:47:43,686 adding 'reinvent_hitl_scoring/scoring/score_components/rest/__init__.py' 2024-09-27T18:47:43,687 adding 'reinvent_hitl_scoring/scoring/score_components/rest/general_rest_component.py' 2024-09-27T18:47:43,689 adding 'reinvent_hitl_scoring/scoring/score_components/rocs/__init__.py' 2024-09-27T18:47:43,690 adding 'reinvent_hitl_scoring/scoring/score_components/rocs/base_rocs_component.py' 2024-09-27T18:47:43,691 adding 'reinvent_hitl_scoring/scoring/score_components/rocs/default_values.py' 2024-09-27T18:47:43,692 adding 'reinvent_hitl_scoring/scoring/score_components/rocs/oefuncs.py' 2024-09-27T18:47:43,694 adding 'reinvent_hitl_scoring/scoring/score_components/rocs/oehelper.py' 2024-09-27T18:47:43,695 adding 'reinvent_hitl_scoring/scoring/score_components/rocs/parallel_rocs_similarity.py' 2024-09-27T18:47:43,696 adding 'reinvent_hitl_scoring/scoring/score_components/rocs/rocs_similarity.py' 2024-09-27T18:47:43,698 adding 'reinvent_hitl_scoring/scoring/score_components/standard/__init__.py' 2024-09-27T18:47:43,700 adding 'reinvent_hitl_scoring/scoring/score_components/standard/chemprop_component.py' 2024-09-27T18:47:43,701 adding 'reinvent_hitl_scoring/scoring/score_components/standard/custom_alerts_component.py' 2024-09-27T18:47:43,702 adding 'reinvent_hitl_scoring/scoring/score_components/standard/jaccard_distance.py' 2024-09-27T18:47:43,703 adding 'reinvent_hitl_scoring/scoring/score_components/standard/matching_substructure.py' 2024-09-27T18:47:43,705 adding 'reinvent_hitl_scoring/scoring/score_components/standard/predictive_property_component.py' 2024-09-27T18:47:43,706 adding 'reinvent_hitl_scoring/scoring/score_components/standard/qed_score.py' 2024-09-27T18:47:43,707 adding 'reinvent_hitl_scoring/scoring/score_components/standard/selectivity_component.py' 2024-09-27T18:47:43,709 adding 'reinvent_hitl_scoring/scoring/score_components/standard/tanimoto_similarity.py' 2024-09-27T18:47:43,711 adding 'reinvent_hitl_scoring/scoring/score_components/structural/__init__.py' 2024-09-27T18:47:43,712 adding 'reinvent_hitl_scoring/scoring/score_components/structural/azdock.py' 2024-09-27T18:47:43,713 adding 'reinvent_hitl_scoring/scoring/score_components/structural/base_structural_component.py' 2024-09-27T18:47:43,715 adding 'reinvent_hitl_scoring/scoring/score_components/structural/dockstream.py' 2024-09-27T18:47:43,717 adding 'reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility/__init__.py' 2024-09-27T18:47:44,136 adding 'reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility/fpscores.pkl.gz' 2024-09-27T18:47:44,162 adding 'reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility/sas_component.py' 2024-09-27T18:47:44,163 adding 'reinvent_hitl_scoring/scoring/score_components/synthetic_accessibility/sascorer.py' 2024-09-27T18:47:44,165 adding 'reinvent_hitl_scoring-0.0.14.dist-info/METADATA' 2024-09-27T18:47:44,166 adding 'reinvent_hitl_scoring-0.0.14.dist-info/WHEEL' 2024-09-27T18:47:44,167 adding 'reinvent_hitl_scoring-0.0.14.dist-info/top_level.txt' 2024-09-27T18:47:44,170 adding 'reinvent_hitl_scoring-0.0.14.dist-info/RECORD' 2024-09-27T18:47:44,211 removing build/bdist.linux-armv7l/wheel 2024-09-27T18:47:44,360 Building wheel for reinvent-hitl-scoring (setup.py): finished with status 'done' 2024-09-27T18:47:44,402 Created wheel for reinvent-hitl-scoring: filename=reinvent_hitl_scoring-0.0.14-py3-none-any.whl size=3955680 sha256=54b7bcab79cc2aabecfce81e910aaa555ffec68032a1e51f58a66fd630ab4373 2024-09-27T18:47:44,403 Stored in directory: /tmp/pip-ephem-wheel-cache-bm0md70o/wheels/d8/cd/96/b735dbcc820a6734f60a172da840dbb34a6d4e03d52f3b0dae 2024-09-27T18:47:44,417 Successfully built reinvent-hitl-scoring 2024-09-27T18:47:44,504 Removed build tracker: '/tmp/pip-build-tracker-lp7qc5ch'