2026-03-27T08:25:15,534 Created temporary directory: /tmp/pip-ephem-wheel-cache-rsz8fyqr 2026-03-27T08:25:15,536 Created temporary directory: /tmp/pip-build-tracker-pnor7070 2026-03-27T08:25:15,536 Initialized build tracking at /tmp/pip-build-tracker-pnor7070 2026-03-27T08:25:15,537 Created build tracker: /tmp/pip-build-tracker-pnor7070 2026-03-27T08:25:15,537 Entered build tracker: /tmp/pip-build-tracker-pnor7070 2026-03-27T08:25:15,538 Created temporary directory: /tmp/pip-wheel-v_bjwc_v 2026-03-27T08:25:15,541 DEPRECATION: --no-binary currently disables reading from the cache of locally built wheels. In the future --no-binary will not influence the wheel cache. pip 23.1 will enforce this behaviour change. A possible replacement is to use the --no-cache-dir option. You can use the flag --use-feature=no-binary-enable-wheel-cache to test the upcoming behaviour. Discussion can be found at https://github.com/pypa/pip/issues/11453 2026-03-27T08:25:15,543 Created temporary directory: /tmp/pip-ephem-wheel-cache-du06wcsl 2026-03-27T08:25:15,565 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2026-03-27T08:25:15,569 2 location(s) to search for versions of chemprop: 2026-03-27T08:25:15,569 * https://pypi.org/simple/chemprop/ 2026-03-27T08:25:15,569 * https://www.piwheels.org/simple/chemprop/ 2026-03-27T08:25:15,569 Fetching project page and analyzing links: https://pypi.org/simple/chemprop/ 2026-03-27T08:25:15,570 Getting page https://pypi.org/simple/chemprop/ 2026-03-27T08:25:15,572 Found index url https://pypi.org/simple 2026-03-27T08:25:15,735 Fetched page https://pypi.org/simple/chemprop/ as application/vnd.pypi.simple.v1+json 2026-03-27T08:25:15,745 Found link https://files.pythonhosted.org/packages/44/99/6be12b242e7b1919e30423d94fea03646e931c84e00ef2f3e1d6270578be/chemprop-1.0.0.tar.gz (from https://pypi.org/simple/chemprop/) (requires-python:>=3.6), version: 1.0.0 2026-03-27T08:25:15,746 Found link https://files.pythonhosted.org/packages/38/2a/f6fc398584b7d35b4e677815f28bc74725cce342a9d428bcd6525f59f315/chemprop-1.0.1.tar.gz (from https://pypi.org/simple/chemprop/) (requires-python:>=3.6), version: 1.0.1 2026-03-27T08:25:15,747 Found link https://files.pythonhosted.org/packages/2a/f1/05aa68fe3475d049a4d1181f0cc577eac6aaba1d29e46468d65f981dec9f/chemprop-1.0.2.tar.gz (from https://pypi.org/simple/chemprop/) (requires-python:>=3.6), version: 1.0.2 2026-03-27T08:25:15,748 Found link https://files.pythonhosted.org/packages/ca/88/5f401ed3111342f56b0f9c3068ac2a7d545e5cf353417505175c2ddddda8/chemprop-1.1.0.tar.gz (from https://pypi.org/simple/chemprop/) (requires-python:>=3.6), version: 1.1.0 2026-03-27T08:25:15,749 Found link https://files.pythonhosted.org/packages/b6/0a/507f86c0bf9fa326e7e8bdb776494b7fee8abf3c71f0a9a48fddaf8c8997/chemprop-1.2.0.tar.gz (from https://pypi.org/simple/chemprop/) (requires-python:>=3.6), version: 1.2.0 2026-03-27T08:25:15,751 Found link https://files.pythonhosted.org/packages/a3/1b/1809bb911a5aeb2fb54a8d0a102a85ee308820a73e0b7b349f604742c167/chemprop-1.3.0.tar.gz (from https://pypi.org/simple/chemprop/) (requires-python:>=3.6), version: 1.3.0 2026-03-27T08:25:15,752 Found link https://files.pythonhosted.org/packages/1c/9a/0c6a285514599fb11947818a47f666d0b685c4e3f7ea98826ac4ca59808d/chemprop-1.3.1.tar.gz (from https://pypi.org/simple/chemprop/) (requires-python:>=3.6), version: 1.3.1 2026-03-27T08:25:15,753 Found link https://files.pythonhosted.org/packages/01/6c/332059382c562cdfbd8daef3682c87331fbb5f205f82e18335323d4e9e6e/chemprop-1.4.1.tar.gz (from https://pypi.org/simple/chemprop/) (requires-python:>=3.6), version: 1.4.1 2026-03-27T08:25:15,754 Found link https://files.pythonhosted.org/packages/34/a5/2cf535b97576eea185371b7c82bf3da94fbd9a49e830b873bb76e13cc7e9/chemprop-1.5.0.tar.gz (from 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https://files.pythonhosted.org/packages/23/d9/ca028609b740af2690a49386c72efaf7ee23ffe4a51e965052a07691ab96/chemprop-2.0.3.tar.gz (from https://pypi.org/simple/chemprop/) (requires-python:>=3.11), version: 2.0.3 2026-03-27T08:25:15,773 Skipping link: No binaries permitted for chemprop: https://files.pythonhosted.org/packages/f0/b5/49781be83dffcd2210f24e93c184c20ce6829aa408ff4e4330ada419519c/chemprop-2.0.4-py3-none-any.whl (from https://pypi.org/simple/chemprop/) (requires-python:>=3.11) 2026-03-27T08:25:15,774 Found link https://files.pythonhosted.org/packages/58/19/b34a4a70515ae73edb5349c0f2eacc352feb3f9ecf406379daab8c20396f/chemprop-2.0.4.tar.gz (from https://pypi.org/simple/chemprop/) (requires-python:>=3.11), version: 2.0.4 2026-03-27T08:25:15,775 Skipping link: No binaries permitted for chemprop: https://files.pythonhosted.org/packages/e0/21/349bb6bbf45a06e3e60a80275f86c06ee81717921afe28f636e8bac98064/chemprop-2.0.5-py3-none-any.whl (from https://pypi.org/simple/chemprop/) 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https://archive1.piwheels.org/simple/chemprop/chemprop-1.6.0-py3-none-any.whl#sha256=d24aa78331463dca4a4cd330f4e6699f515148a9e9ef25719e5a0c8d6c264259 (from https://www.piwheels.org/simple/chemprop/) (requires-python:>=3.7) 2026-03-27T08:25:15,992 Skipping link: No binaries permitted for chemprop: https://archive1.piwheels.org/simple/chemprop/chemprop-1.5.2-py3-none-any.whl#sha256=6d0abc06f42a696ab9629ea38fa357c9f2ac87059a53c8af3d1f689fe9267ece (from https://www.piwheels.org/simple/chemprop/) (requires-python:>=3.7) 2026-03-27T08:25:15,993 Skipping link: No binaries permitted for chemprop: https://archive1.piwheels.org/simple/chemprop/chemprop-1.5.1-py3-none-any.whl#sha256=4afbffbc588b0bf2d76f68094662d2e9c691298228c0161bead133fa662241e3 (from https://www.piwheels.org/simple/chemprop/) (requires-python:>=3.6) 2026-03-27T08:25:15,993 Skipping link: No binaries permitted for chemprop: https://archive1.piwheels.org/simple/chemprop/chemprop-1.5.0-py3-none-any.whl#sha256=8fe9987ed247550134fe4cbafc53e2f9613ca57c0c3249f2fc7345a6ccd6e3b9 (from https://www.piwheels.org/simple/chemprop/) (requires-python:>=3.6) 2026-03-27T08:25:15,993 Skipping link: No binaries permitted for chemprop: https://archive1.piwheels.org/simple/chemprop/chemprop-1.4.1-py3-none-any.whl#sha256=8f76d08b5c7e47e2fe6080400f05d1458d17edc60ed2ef5f40d758123a2de220 (from https://www.piwheels.org/simple/chemprop/) (requires-python:>=3.6) 2026-03-27T08:25:15,994 Skipping link: No binaries permitted for chemprop: https://archive1.piwheels.org/simple/chemprop/chemprop-1.3.1-py3-none-any.whl#sha256=bc0a910eeaf37758d3881d8e1b5fc3a837f23a140839bde1e5dd3fa5472bbb37 (from https://www.piwheels.org/simple/chemprop/) (requires-python:>=3.6) 2026-03-27T08:25:15,994 Skipping link: No binaries permitted for chemprop: https://archive1.piwheels.org/simple/chemprop/chemprop-1.3.0-py3-none-any.whl#sha256=95073a6381112777b672536985dc52f86cfd93f16d734cc3269b9f52a8b9e1cf (from https://www.piwheels.org/simple/chemprop/) (requires-python:>=3.6) 2026-03-27T08:25:15,995 Skipping link: No binaries permitted for chemprop: https://archive1.piwheels.org/simple/chemprop/chemprop-1.2.0-py3-none-any.whl#sha256=dbab9de8f1fde889df012351f9472f2b5aeef8f32687e0fd61063fd84241c0cf (from https://www.piwheels.org/simple/chemprop/) (requires-python:>=3.6) 2026-03-27T08:25:15,995 Skipping link: No binaries permitted for chemprop: https://archive1.piwheels.org/simple/chemprop/chemprop-1.1.0-py3-none-any.whl#sha256=38a5fb6ceea0d22a2bf1e678dccf74799375de98572a2ae0e7590c73548576d4 (from https://www.piwheels.org/simple/chemprop/) (requires-python:>=3.6) 2026-03-27T08:25:15,996 Skipping link: No binaries permitted for chemprop: https://archive1.piwheels.org/simple/chemprop/chemprop-1.0.2-py3-none-any.whl#sha256=a795a10c12be0e0a9edf5a7e10d1f9ec4f72b709477c844f46841edbed1d9b79 (from https://www.piwheels.org/simple/chemprop/) (requires-python:>=3.6) 2026-03-27T08:25:15,997 Skipping link: No binaries permitted for chemprop: https://archive1.piwheels.org/simple/chemprop/chemprop-1.0.1-py3-none-any.whl#sha256=f84b2db11274ec940e8849847ea1f609b1adcd51677720410c048c2fc3672b55 (from https://www.piwheels.org/simple/chemprop/) (requires-python:>=3.6) 2026-03-27T08:25:15,997 Skipping link: not a file: https://www.piwheels.org/simple/chemprop/ 2026-03-27T08:25:15,998 Skipping link: not a file: https://pypi.org/simple/chemprop/ 2026-03-27T08:25:16,022 Given no hashes to check 1 links for project 'chemprop': discarding no candidates 2026-03-27T08:25:16,041 Collecting chemprop==2.2.3 2026-03-27T08:25:16,044 Created temporary directory: /tmp/pip-unpack-5rvjp1ty 2026-03-27T08:25:21,352 Downloading chemprop-2.2.3.tar.gz (131 kB) 2026-03-27T08:25:21,646 Added chemprop==2.2.3 from https://files.pythonhosted.org/packages/f6/fb/9b3228f54382a116507801a66fef96c220f22b4157bc6419c5d2d81ad735/chemprop-2.2.3.tar.gz to build tracker '/tmp/pip-build-tracker-pnor7070' 2026-03-27T08:25:21,654 Created temporary directory: /tmp/pip-build-env-___71mer 2026-03-27T08:25:21,658 Installing build dependencies: started 2026-03-27T08:25:21,659 Running command pip subprocess to install build dependencies 2026-03-27T08:25:21,690 Error processing line 1 of /home/piwheels/.local/lib/python3.11/site-packages/hazimpp_autorun.pth: 2026-03-27T08:25:21,728 Traceback (most recent call last): 2026-03-27T08:25:21,729 File "", line 192, in addpackage 2026-03-27T08:25:21,729 File "", line 1, in 2026-03-27T08:25:21,730 ModuleNotFoundError: No module named 'hazimpp' 2026-03-27T08:25:21,731 Remainder of file ignored 2026-03-27T08:25:22,820 Using pip 23.0.1 from /usr/lib/python3/dist-packages/pip (python 3.11) 2026-03-27T08:25:23,242 DEPRECATION: --no-binary currently disables reading from the cache of locally built wheels. In the future --no-binary will not influence the wheel cache. pip 23.1 will enforce this behaviour change. A possible replacement is to use the --no-cache-dir option. You can use the flag --use-feature=no-binary-enable-wheel-cache to test the upcoming behaviour. Discussion can be found at https://github.com/pypa/pip/issues/11453 2026-03-27T08:25:23,264 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2026-03-27T08:25:25,077 Collecting setuptools>=45 2026-03-27T08:25:25,156 Using cached https://www.piwheels.org/simple/setuptools/setuptools-82.0.1-py3-none-any.whl (1.0 MB) 2026-03-27T08:25:25,421 Collecting wheel 2026-03-27T08:25:25,438 Using cached https://www.piwheels.org/simple/wheel/wheel-0.46.3-py3-none-any.whl (30 kB) 2026-03-27T08:25:25,807 Collecting setuptools_scm[toml]>=6.2 2026-03-27T08:25:25,824 Using cached https://www.piwheels.org/simple/setuptools-scm/setuptools_scm-10.0.3-py3-none-any.whl (20 kB) 2026-03-27T08:25:26,011 Collecting packaging>=24.0 2026-03-27T08:25:26,025 Using cached https://www.piwheels.org/simple/packaging/packaging-26.0-py3-none-any.whl (74 kB) 2026-03-27T08:25:26,103 Collecting vcs-versioning>=1.0.0.dev0 2026-03-27T08:25:26,118 Using cached https://www.piwheels.org/simple/vcs-versioning/vcs_versioning-1.0.1-py3-none-any.whl (78 kB) 2026-03-27T08:25:29,136 Installing collected packages: setuptools, packaging, wheel, vcs-versioning, setuptools_scm 2026-03-27T08:25:32,473 Creating /tmp/pip-build-env-___71mer/overlay/local/bin 2026-03-27T08:25:32,475 changing mode of /tmp/pip-build-env-___71mer/overlay/local/bin/wheel to 755 2026-03-27T08:25:32,766 changing mode of /tmp/pip-build-env-___71mer/overlay/local/bin/vcs-versioning to 755 2026-03-27T08:25:32,865 changing mode of /tmp/pip-build-env-___71mer/overlay/local/bin/setuptools-scm to 755 2026-03-27T08:25:32,897 Successfully installed packaging-26.0 setuptools-82.0.1 setuptools_scm-10.0.3 vcs-versioning-1.0.1 wheel-0.46.3 2026-03-27T08:25:33,185 Installing build dependencies: finished with status 'done' 2026-03-27T08:25:33,191 Getting requirements to build wheel: started 2026-03-27T08:25:33,192 Running command Getting requirements to build wheel 2026-03-27T08:25:33,833 toml section missing PosixPath('pyproject.toml') does not contain any of the tool sections: ['setuptools_scm', 'vcs-versioning'] 2026-03-27T08:25:33,880 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/setuptools/config/_apply_pyprojecttoml.py:82: SetuptoolsDeprecationWarning: `project.license` as a TOML table is deprecated 2026-03-27T08:25:33,881 !! 2026-03-27T08:25:33,882 ******************************************************************************** 2026-03-27T08:25:33,882 Please use a simple string containing a SPDX expression for `project.license`. You can also use `project.license-files`. (Both options available on setuptools>=77.0.0). 2026-03-27T08:25:33,884 By 2027-Feb-18, you need to update your project and remove deprecated calls 2026-03-27T08:25:33,884 or your builds will no longer be supported. 2026-03-27T08:25:33,886 See https://packaging.python.org/en/latest/guides/writing-pyproject-toml/#license for details. 2026-03-27T08:25:33,886 ******************************************************************************** 2026-03-27T08:25:33,887 !! 2026-03-27T08:25:33,887 corresp(dist, value, root_dir) 2026-03-27T08:25:33,958 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/setuptools/config/_apply_pyprojecttoml.py:61: SetuptoolsDeprecationWarning: License classifiers are deprecated. 2026-03-27T08:25:33,959 !! 2026-03-27T08:25:33,960 ******************************************************************************** 2026-03-27T08:25:33,960 Please consider removing the following classifiers in favor of a SPDX license expression: 2026-03-27T08:25:33,961 License :: OSI Approved :: MIT License 2026-03-27T08:25:33,962 See https://packaging.python.org/en/latest/guides/writing-pyproject-toml/#license for details. 2026-03-27T08:25:33,962 ******************************************************************************** 2026-03-27T08:25:33,964 !! 2026-03-27T08:25:33,964 dist._finalize_license_expression() 2026-03-27T08:25:33,965 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/setuptools/dist.py:765: SetuptoolsDeprecationWarning: License classifiers are deprecated. 2026-03-27T08:25:33,965 !! 2026-03-27T08:25:33,966 ******************************************************************************** 2026-03-27T08:25:33,966 Please consider removing the following classifiers in favor of a SPDX license expression: 2026-03-27T08:25:33,967 License :: OSI Approved :: MIT License 2026-03-27T08:25:33,968 See https://packaging.python.org/en/latest/guides/writing-pyproject-toml/#license for details. 2026-03-27T08:25:33,969 ******************************************************************************** 2026-03-27T08:25:33,970 !! 2026-03-27T08:25:33,971 self._finalize_license_expression() 2026-03-27T08:25:33,972 running egg_info 2026-03-27T08:25:33,979 writing chemprop.egg-info/PKG-INFO 2026-03-27T08:25:33,989 writing dependency_links to chemprop.egg-info/dependency_links.txt 2026-03-27T08:25:33,991 writing entry points to chemprop.egg-info/entry_points.txt 2026-03-27T08:25:33,996 writing requirements to chemprop.egg-info/requires.txt 2026-03-27T08:25:33,997 writing top-level names to chemprop.egg-info/top_level.txt 2026-03-27T08:25:34,031 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/vcs_versioning/overrides.py:609: UserWarning: No GlobalOverrides context is active. Auto-creating one with SETUPTOOLS_SCM prefix for backwards compatibility. Consider using 'with GlobalOverrides.from_env("YOUR_TOOL"):' explicitly. 2026-03-27T08:25:34,032 return get_active_overrides().subprocess_timeout 2026-03-27T08:25:34,039 listing git files failed - pretending there aren't any 2026-03-27T08:25:34,048 reading manifest file 'chemprop.egg-info/SOURCES.txt' 2026-03-27T08:25:34,054 reading manifest template 'MANIFEST.in' 2026-03-27T08:25:34,081 warning: no previously-included files matching '*.pyc' found anywhere in distribution 2026-03-27T08:25:34,081 warning: no previously-included files matching '__pycache__' found anywhere in distribution 2026-03-27T08:25:34,082 no previously-included directories found matching 'tests' 2026-03-27T08:25:34,083 no previously-included directories found matching 'docs' 2026-03-27T08:25:34,083 no previously-included directories found matching 'notebooks' 2026-03-27T08:25:34,084 no previously-included directories found matching 'examples' 2026-03-27T08:25:34,085 no previously-included directories found matching 'requirements' 2026-03-27T08:25:34,085 no previously-included directories found matching '.github' 2026-03-27T08:25:34,086 adding license file 'LICENSE.txt' 2026-03-27T08:25:34,091 writing manifest file 'chemprop.egg-info/SOURCES.txt' 2026-03-27T08:25:34,194 Getting requirements to build wheel: finished with status 'done' 2026-03-27T08:25:34,198 Created temporary directory: /tmp/pip-modern-metadata-23r5atqv 2026-03-27T08:25:34,200 Preparing metadata (pyproject.toml): started 2026-03-27T08:25:34,201 Running command Preparing metadata (pyproject.toml) 2026-03-27T08:25:34,797 toml section missing PosixPath('pyproject.toml') does not contain any of the tool sections: ['setuptools_scm', 'vcs-versioning'] 2026-03-27T08:25:34,841 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/setuptools/config/_apply_pyprojecttoml.py:82: SetuptoolsDeprecationWarning: `project.license` as a TOML table is deprecated 2026-03-27T08:25:34,841 !! 2026-03-27T08:25:34,842 ******************************************************************************** 2026-03-27T08:25:34,843 Please use a simple string containing a SPDX expression for `project.license`. You can also use `project.license-files`. (Both options available on setuptools>=77.0.0). 2026-03-27T08:25:34,844 By 2027-Feb-18, you need to update your project and remove deprecated calls 2026-03-27T08:25:34,844 or your builds will no longer be supported. 2026-03-27T08:25:34,845 See https://packaging.python.org/en/latest/guides/writing-pyproject-toml/#license for details. 2026-03-27T08:25:34,846 ******************************************************************************** 2026-03-27T08:25:34,846 !! 2026-03-27T08:25:34,847 corresp(dist, value, root_dir) 2026-03-27T08:25:34,913 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/setuptools/config/_apply_pyprojecttoml.py:61: SetuptoolsDeprecationWarning: License classifiers are deprecated. 2026-03-27T08:25:34,913 !! 2026-03-27T08:25:34,914 ******************************************************************************** 2026-03-27T08:25:34,915 Please consider removing the following classifiers in favor of a SPDX license expression: 2026-03-27T08:25:34,916 License :: OSI Approved :: MIT License 2026-03-27T08:25:34,917 See https://packaging.python.org/en/latest/guides/writing-pyproject-toml/#license for details. 2026-03-27T08:25:34,918 ******************************************************************************** 2026-03-27T08:25:34,919 !! 2026-03-27T08:25:34,920 dist._finalize_license_expression() 2026-03-27T08:25:34,920 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/setuptools/dist.py:765: SetuptoolsDeprecationWarning: License classifiers are deprecated. 2026-03-27T08:25:34,921 !! 2026-03-27T08:25:34,922 ******************************************************************************** 2026-03-27T08:25:34,923 Please consider removing the following classifiers in favor of a SPDX license expression: 2026-03-27T08:25:34,924 License :: OSI Approved :: MIT License 2026-03-27T08:25:34,925 See https://packaging.python.org/en/latest/guides/writing-pyproject-toml/#license for details. 2026-03-27T08:25:34,926 ******************************************************************************** 2026-03-27T08:25:34,927 !! 2026-03-27T08:25:34,927 self._finalize_license_expression() 2026-03-27T08:25:34,928 running dist_info 2026-03-27T08:25:34,941 creating /tmp/pip-modern-metadata-23r5atqv/chemprop.egg-info 2026-03-27T08:25:34,942 writing /tmp/pip-modern-metadata-23r5atqv/chemprop.egg-info/PKG-INFO 2026-03-27T08:25:34,951 writing dependency_links to /tmp/pip-modern-metadata-23r5atqv/chemprop.egg-info/dependency_links.txt 2026-03-27T08:25:34,953 writing entry points to /tmp/pip-modern-metadata-23r5atqv/chemprop.egg-info/entry_points.txt 2026-03-27T08:25:34,958 writing requirements to /tmp/pip-modern-metadata-23r5atqv/chemprop.egg-info/requires.txt 2026-03-27T08:25:34,959 writing top-level names to /tmp/pip-modern-metadata-23r5atqv/chemprop.egg-info/top_level.txt 2026-03-27T08:25:34,960 writing manifest file '/tmp/pip-modern-metadata-23r5atqv/chemprop.egg-info/SOURCES.txt' 2026-03-27T08:25:34,991 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/vcs_versioning/overrides.py:609: UserWarning: No GlobalOverrides context is active. Auto-creating one with SETUPTOOLS_SCM prefix for backwards compatibility. Consider using 'with GlobalOverrides.from_env("YOUR_TOOL"):' explicitly. 2026-03-27T08:25:34,992 return get_active_overrides().subprocess_timeout 2026-03-27T08:25:34,998 listing git files failed - pretending there aren't any 2026-03-27T08:25:35,005 reading manifest file '/tmp/pip-modern-metadata-23r5atqv/chemprop.egg-info/SOURCES.txt' 2026-03-27T08:25:35,007 reading manifest template 'MANIFEST.in' 2026-03-27T08:25:35,034 warning: no previously-included files matching '*.pyc' found anywhere in distribution 2026-03-27T08:25:35,034 warning: no previously-included files matching '__pycache__' found anywhere in distribution 2026-03-27T08:25:35,035 no previously-included directories found matching 'tests' 2026-03-27T08:25:35,035 no previously-included directories found matching 'docs' 2026-03-27T08:25:35,036 no previously-included directories found matching 'notebooks' 2026-03-27T08:25:35,037 no previously-included directories found matching 'examples' 2026-03-27T08:25:35,037 no previously-included directories found matching 'requirements' 2026-03-27T08:25:35,038 no previously-included directories found matching '.github' 2026-03-27T08:25:35,038 adding license file 'LICENSE.txt' 2026-03-27T08:25:35,042 writing manifest file '/tmp/pip-modern-metadata-23r5atqv/chemprop.egg-info/SOURCES.txt' 2026-03-27T08:25:35,043 creating '/tmp/pip-modern-metadata-23r5atqv/chemprop-2.2.3.dist-info' 2026-03-27T08:25:35,174 Preparing metadata (pyproject.toml): finished with status 'done' 2026-03-27T08:25:35,179 Source in /tmp/pip-wheel-v_bjwc_v/chemprop_16ccf118802b41cea66e2329e521733f has version 2.2.3, which satisfies requirement chemprop==2.2.3 from https://files.pythonhosted.org/packages/f6/fb/9b3228f54382a116507801a66fef96c220f22b4157bc6419c5d2d81ad735/chemprop-2.2.3.tar.gz 2026-03-27T08:25:35,180 Removed chemprop==2.2.3 from https://files.pythonhosted.org/packages/f6/fb/9b3228f54382a116507801a66fef96c220f22b4157bc6419c5d2d81ad735/chemprop-2.2.3.tar.gz from build tracker '/tmp/pip-build-tracker-pnor7070' 2026-03-27T08:25:35,187 Created temporary directory: /tmp/pip-unpack-l8w_6huv 2026-03-27T08:25:35,187 Building wheels for collected packages: chemprop 2026-03-27T08:25:35,192 Created temporary directory: /tmp/pip-wheel-j4hn3r_e 2026-03-27T08:25:35,192 Destination directory: /tmp/pip-wheel-j4hn3r_e 2026-03-27T08:25:35,195 Building wheel for chemprop (pyproject.toml): started 2026-03-27T08:25:35,196 Running command Building wheel for chemprop (pyproject.toml) 2026-03-27T08:25:35,777 toml section missing PosixPath('pyproject.toml') does not contain any of the tool sections: ['setuptools_scm', 'vcs-versioning'] 2026-03-27T08:25:35,818 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/setuptools/config/_apply_pyprojecttoml.py:82: SetuptoolsDeprecationWarning: `project.license` as a TOML table is deprecated 2026-03-27T08:25:35,819 !! 2026-03-27T08:25:35,820 ******************************************************************************** 2026-03-27T08:25:35,821 Please use a simple string containing a SPDX expression for `project.license`. You can also use `project.license-files`. (Both options available on setuptools>=77.0.0). 2026-03-27T08:25:35,822 By 2027-Feb-18, you need to update your project and remove deprecated calls 2026-03-27T08:25:35,822 or your builds will no longer be supported. 2026-03-27T08:25:35,824 See https://packaging.python.org/en/latest/guides/writing-pyproject-toml/#license for details. 2026-03-27T08:25:35,824 ******************************************************************************** 2026-03-27T08:25:35,825 !! 2026-03-27T08:25:35,826 corresp(dist, value, root_dir) 2026-03-27T08:25:35,885 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/setuptools/config/_apply_pyprojecttoml.py:61: SetuptoolsDeprecationWarning: License classifiers are deprecated. 2026-03-27T08:25:35,886 !! 2026-03-27T08:25:35,887 ******************************************************************************** 2026-03-27T08:25:35,887 Please consider removing the following classifiers in favor of a SPDX license expression: 2026-03-27T08:25:35,888 License :: OSI Approved :: MIT License 2026-03-27T08:25:35,889 See https://packaging.python.org/en/latest/guides/writing-pyproject-toml/#license for details. 2026-03-27T08:25:35,890 ******************************************************************************** 2026-03-27T08:25:35,890 !! 2026-03-27T08:25:35,891 dist._finalize_license_expression() 2026-03-27T08:25:35,892 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/setuptools/dist.py:765: SetuptoolsDeprecationWarning: License classifiers are deprecated. 2026-03-27T08:25:35,893 !! 2026-03-27T08:25:35,894 ******************************************************************************** 2026-03-27T08:25:35,894 Please consider removing the following classifiers in favor of a SPDX license expression: 2026-03-27T08:25:35,895 License :: OSI Approved :: MIT License 2026-03-27T08:25:35,896 See https://packaging.python.org/en/latest/guides/writing-pyproject-toml/#license for details. 2026-03-27T08:25:35,896 ******************************************************************************** 2026-03-27T08:25:35,898 !! 2026-03-27T08:25:35,898 self._finalize_license_expression() 2026-03-27T08:25:35,899 running bdist_wheel 2026-03-27T08:25:35,918 running build 2026-03-27T08:25:35,919 running build_py 2026-03-27T08:25:35,920 creating build/lib/chemprop 2026-03-27T08:25:35,922 copying chemprop/schedulers.py -> build/lib/chemprop 2026-03-27T08:25:35,924 copying chemprop/types.py -> build/lib/chemprop 2026-03-27T08:25:35,927 copying chemprop/exceptions.py -> build/lib/chemprop 2026-03-27T08:25:35,928 copying chemprop/__init__.py -> build/lib/chemprop 2026-03-27T08:25:35,930 copying chemprop/conf.py -> build/lib/chemprop 2026-03-27T08:25:35,931 running egg_info 2026-03-27T08:25:35,944 writing chemprop.egg-info/PKG-INFO 2026-03-27T08:25:35,953 writing dependency_links to chemprop.egg-info/dependency_links.txt 2026-03-27T08:25:35,954 writing entry points to chemprop.egg-info/entry_points.txt 2026-03-27T08:25:35,959 writing requirements to chemprop.egg-info/requires.txt 2026-03-27T08:25:35,960 writing top-level names to chemprop.egg-info/top_level.txt 2026-03-27T08:25:35,985 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/vcs_versioning/overrides.py:609: UserWarning: No GlobalOverrides context is active. Auto-creating one with SETUPTOOLS_SCM prefix for backwards compatibility. Consider using 'with GlobalOverrides.from_env("YOUR_TOOL"):' explicitly. 2026-03-27T08:25:35,986 return get_active_overrides().subprocess_timeout 2026-03-27T08:25:35,991 listing git files failed - pretending there aren't any 2026-03-27T08:25:35,998 reading manifest file 'chemprop.egg-info/SOURCES.txt' 2026-03-27T08:25:36,004 reading manifest template 'MANIFEST.in' 2026-03-27T08:25:36,030 warning: no previously-included files matching '*.pyc' found anywhere in distribution 2026-03-27T08:25:36,031 warning: no previously-included files matching '__pycache__' found anywhere in distribution 2026-03-27T08:25:36,032 no previously-included directories found matching 'tests' 2026-03-27T08:25:36,032 no previously-included directories found matching 'docs' 2026-03-27T08:25:36,033 no previously-included directories found matching 'notebooks' 2026-03-27T08:25:36,034 no previously-included directories found matching 'examples' 2026-03-27T08:25:36,034 no previously-included directories found matching 'requirements' 2026-03-27T08:25:36,035 no previously-included directories found matching '.github' 2026-03-27T08:25:36,036 adding license file 'LICENSE.txt' 2026-03-27T08:25:36,040 writing manifest file 'chemprop.egg-info/SOURCES.txt' 2026-03-27T08:25:36,043 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:215: _Warning: Package 'chemprop.cli' is absent from the `packages` configuration. 2026-03-27T08:25:36,043 !! 2026-03-27T08:25:36,044 ******************************************************************************** 2026-03-27T08:25:36,045 ############################ 2026-03-27T08:25:36,045 # Package would be ignored # 2026-03-27T08:25:36,046 ############################ 2026-03-27T08:25:36,046 Python recognizes 'chemprop.cli' as an importable package[^1], 2026-03-27T08:25:36,047 but it is absent from setuptools' `packages` configuration. 2026-03-27T08:25:36,048 This leads to an ambiguous overall configuration. If you want to distribute this 2026-03-27T08:25:36,048 package, please make sure that 'chemprop.cli' is explicitly added 2026-03-27T08:25:36,049 to the `packages` configuration field. 2026-03-27T08:25:36,050 Alternatively, you can also rely on setuptools' discovery methods 2026-03-27T08:25:36,050 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2026-03-27T08:25:36,051 instead of `find_packages(...)`/`find:`). 2026-03-27T08:25:36,051 You can read more about "package discovery" on setuptools documentation page: 2026-03-27T08:25:36,052 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2026-03-27T08:25:36,053 If you don't want 'chemprop.cli' to be distributed and are 2026-03-27T08:25:36,054 already explicitly excluding 'chemprop.cli' via 2026-03-27T08:25:36,055 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2026-03-27T08:25:36,055 you can try to use `exclude_package_data`, or `include-package-data=False` in 2026-03-27T08:25:36,056 combination with a more fine grained `package-data` configuration. 2026-03-27T08:25:36,057 You can read more about "package data files" on setuptools documentation page: 2026-03-27T08:25:36,058 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2026-03-27T08:25:36,059 [^1]: For Python, any directory (with suitable naming) can be imported, 2026-03-27T08:25:36,060 even if it does not contain any `.py` files. 2026-03-27T08:25:36,060 On the other hand, currently there is no concept of package data 2026-03-27T08:25:36,061 directory, all directories are treated like packages. 2026-03-27T08:25:36,061 ******************************************************************************** 2026-03-27T08:25:36,063 !! 2026-03-27T08:25:36,063 check.warn(importable) 2026-03-27T08:25:36,064 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:215: _Warning: Package 'chemprop.cli.utils' is absent from the `packages` configuration. 2026-03-27T08:25:36,064 !! 2026-03-27T08:25:36,065 ******************************************************************************** 2026-03-27T08:25:36,066 ############################ 2026-03-27T08:25:36,066 # Package would be ignored # 2026-03-27T08:25:36,067 ############################ 2026-03-27T08:25:36,067 Python recognizes 'chemprop.cli.utils' as an importable package[^1], 2026-03-27T08:25:36,068 but it is absent from setuptools' `packages` configuration. 2026-03-27T08:25:36,069 This leads to an ambiguous overall configuration. If you want to distribute this 2026-03-27T08:25:36,070 package, please make sure that 'chemprop.cli.utils' is explicitly added 2026-03-27T08:25:36,070 to the `packages` configuration field. 2026-03-27T08:25:36,071 Alternatively, you can also rely on setuptools' discovery methods 2026-03-27T08:25:36,072 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2026-03-27T08:25:36,073 instead of `find_packages(...)`/`find:`). 2026-03-27T08:25:36,074 You can read more about "package discovery" on setuptools documentation page: 2026-03-27T08:25:36,075 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2026-03-27T08:25:36,076 If you don't want 'chemprop.cli.utils' to be distributed and are 2026-03-27T08:25:36,076 already explicitly excluding 'chemprop.cli.utils' via 2026-03-27T08:25:36,077 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2026-03-27T08:25:36,077 you can try to use `exclude_package_data`, or `include-package-data=False` in 2026-03-27T08:25:36,079 combination with a more fine grained `package-data` configuration. 2026-03-27T08:25:36,080 You can read more about "package data files" on setuptools documentation page: 2026-03-27T08:25:36,081 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2026-03-27T08:25:36,083 [^1]: For Python, any directory (with suitable naming) can be imported, 2026-03-27T08:25:36,083 even if it does not contain any `.py` files. 2026-03-27T08:25:36,084 On the other hand, currently there is no concept of package data 2026-03-27T08:25:36,085 directory, all directories are treated like packages. 2026-03-27T08:25:36,085 ******************************************************************************** 2026-03-27T08:25:36,086 !! 2026-03-27T08:25:36,087 check.warn(importable) 2026-03-27T08:25:36,087 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:215: _Warning: Package 'chemprop.data' is absent from the `packages` configuration. 2026-03-27T08:25:36,088 !! 2026-03-27T08:25:36,089 ******************************************************************************** 2026-03-27T08:25:36,089 ############################ 2026-03-27T08:25:36,090 # Package would be ignored # 2026-03-27T08:25:36,090 ############################ 2026-03-27T08:25:36,091 Python recognizes 'chemprop.data' as an importable package[^1], 2026-03-27T08:25:36,091 but it is absent from setuptools' `packages` configuration. 2026-03-27T08:25:36,092 This leads to an ambiguous overall configuration. If you want to distribute this 2026-03-27T08:25:36,093 package, please make sure that 'chemprop.data' is explicitly added 2026-03-27T08:25:36,094 to the `packages` configuration field. 2026-03-27T08:25:36,095 Alternatively, you can also rely on setuptools' discovery methods 2026-03-27T08:25:36,095 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2026-03-27T08:25:36,096 instead of `find_packages(...)`/`find:`). 2026-03-27T08:25:36,097 You can read more about "package discovery" on setuptools documentation page: 2026-03-27T08:25:36,099 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2026-03-27T08:25:36,100 If you don't want 'chemprop.data' to be distributed and are 2026-03-27T08:25:36,100 already explicitly excluding 'chemprop.data' via 2026-03-27T08:25:36,101 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2026-03-27T08:25:36,102 you can try to use `exclude_package_data`, or `include-package-data=False` in 2026-03-27T08:25:36,102 combination with a more fine grained `package-data` configuration. 2026-03-27T08:25:36,103 You can read more about "package data files" on setuptools documentation page: 2026-03-27T08:25:36,104 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2026-03-27T08:25:36,106 [^1]: For Python, any directory (with suitable naming) can be imported, 2026-03-27T08:25:36,107 even if it does not contain any `.py` files. 2026-03-27T08:25:36,107 On the other hand, currently there is no concept of package data 2026-03-27T08:25:36,108 directory, all directories are treated like packages. 2026-03-27T08:25:36,108 ******************************************************************************** 2026-03-27T08:25:36,109 !! 2026-03-27T08:25:36,110 check.warn(importable) 2026-03-27T08:25:36,110 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:215: _Warning: Package 'chemprop.featurizers' is absent from the `packages` configuration. 2026-03-27T08:25:36,111 !! 2026-03-27T08:25:36,112 ******************************************************************************** 2026-03-27T08:25:36,113 ############################ 2026-03-27T08:25:36,113 # Package would be ignored # 2026-03-27T08:25:36,114 ############################ 2026-03-27T08:25:36,115 Python recognizes 'chemprop.featurizers' as an importable package[^1], 2026-03-27T08:25:36,115 but it is absent from setuptools' `packages` configuration. 2026-03-27T08:25:36,116 This leads to an ambiguous overall configuration. If you want to distribute this 2026-03-27T08:25:36,117 package, please make sure that 'chemprop.featurizers' is explicitly added 2026-03-27T08:25:36,117 to the `packages` configuration field. 2026-03-27T08:25:36,118 Alternatively, you can also rely on setuptools' discovery methods 2026-03-27T08:25:36,119 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2026-03-27T08:25:36,119 instead of `find_packages(...)`/`find:`). 2026-03-27T08:25:36,120 You can read more about "package discovery" on setuptools documentation page: 2026-03-27T08:25:36,122 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2026-03-27T08:25:36,123 If you don't want 'chemprop.featurizers' to be distributed and are 2026-03-27T08:25:36,123 already explicitly excluding 'chemprop.featurizers' via 2026-03-27T08:25:36,124 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2026-03-27T08:25:36,124 you can try to use `exclude_package_data`, or `include-package-data=False` in 2026-03-27T08:25:36,125 combination with a more fine grained `package-data` configuration. 2026-03-27T08:25:36,126 You can read more about "package data files" on setuptools documentation page: 2026-03-27T08:25:36,127 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2026-03-27T08:25:36,128 [^1]: For Python, any directory (with suitable naming) can be imported, 2026-03-27T08:25:36,129 even if it does not contain any `.py` files. 2026-03-27T08:25:36,129 On the other hand, currently there is no concept of package data 2026-03-27T08:25:36,130 directory, all directories are treated like packages. 2026-03-27T08:25:36,130 ******************************************************************************** 2026-03-27T08:25:36,131 !! 2026-03-27T08:25:36,132 check.warn(importable) 2026-03-27T08:25:36,132 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:215: _Warning: Package 'chemprop.featurizers.molgraph' is absent from the `packages` configuration. 2026-03-27T08:25:36,133 !! 2026-03-27T08:25:36,134 ******************************************************************************** 2026-03-27T08:25:36,135 ############################ 2026-03-27T08:25:36,135 # Package would be ignored # 2026-03-27T08:25:36,136 ############################ 2026-03-27T08:25:36,136 Python recognizes 'chemprop.featurizers.molgraph' as an importable package[^1], 2026-03-27T08:25:36,137 but it is absent from setuptools' `packages` configuration. 2026-03-27T08:25:36,138 This leads to an ambiguous overall configuration. If you want to distribute this 2026-03-27T08:25:36,139 package, please make sure that 'chemprop.featurizers.molgraph' is explicitly added 2026-03-27T08:25:36,139 to the `packages` configuration field. 2026-03-27T08:25:36,140 Alternatively, you can also rely on setuptools' discovery methods 2026-03-27T08:25:36,141 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2026-03-27T08:25:36,141 instead of `find_packages(...)`/`find:`). 2026-03-27T08:25:36,142 You can read more about "package discovery" on setuptools documentation page: 2026-03-27T08:25:36,143 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2026-03-27T08:25:36,144 If you don't want 'chemprop.featurizers.molgraph' to be distributed and are 2026-03-27T08:25:36,144 already explicitly excluding 'chemprop.featurizers.molgraph' via 2026-03-27T08:25:36,145 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2026-03-27T08:25:36,145 you can try to use `exclude_package_data`, or `include-package-data=False` in 2026-03-27T08:25:36,146 combination with a more fine grained `package-data` configuration. 2026-03-27T08:25:36,147 You can read more about "package data files" on setuptools documentation page: 2026-03-27T08:25:36,148 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2026-03-27T08:25:36,149 [^1]: For Python, any directory (with suitable naming) can be imported, 2026-03-27T08:25:36,150 even if it does not contain any `.py` files. 2026-03-27T08:25:36,150 On the other hand, currently there is no concept of package data 2026-03-27T08:25:36,151 directory, all directories are treated like packages. 2026-03-27T08:25:36,151 ******************************************************************************** 2026-03-27T08:25:36,152 !! 2026-03-27T08:25:36,153 check.warn(importable) 2026-03-27T08:25:36,153 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:215: _Warning: Package 'chemprop.models' is absent from the `packages` configuration. 2026-03-27T08:25:36,154 !! 2026-03-27T08:25:36,155 ******************************************************************************** 2026-03-27T08:25:36,155 ############################ 2026-03-27T08:25:36,156 # Package would be ignored # 2026-03-27T08:25:36,156 ############################ 2026-03-27T08:25:36,157 Python recognizes 'chemprop.models' as an importable package[^1], 2026-03-27T08:25:36,157 but it is absent from setuptools' `packages` configuration. 2026-03-27T08:25:36,158 This leads to an ambiguous overall configuration. If you want to distribute this 2026-03-27T08:25:36,159 package, please make sure that 'chemprop.models' is explicitly added 2026-03-27T08:25:36,160 to the `packages` configuration field. 2026-03-27T08:25:36,161 Alternatively, you can also rely on setuptools' discovery methods 2026-03-27T08:25:36,161 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2026-03-27T08:25:36,162 instead of `find_packages(...)`/`find:`). 2026-03-27T08:25:36,163 You can read more about "package discovery" on setuptools documentation page: 2026-03-27T08:25:36,164 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2026-03-27T08:25:36,166 If you don't want 'chemprop.models' to be distributed and are 2026-03-27T08:25:36,166 already explicitly excluding 'chemprop.models' via 2026-03-27T08:25:36,167 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2026-03-27T08:25:36,167 you can try to use `exclude_package_data`, or `include-package-data=False` in 2026-03-27T08:25:36,168 combination with a more fine grained `package-data` configuration. 2026-03-27T08:25:36,169 You can read more about "package data files" on setuptools documentation page: 2026-03-27T08:25:36,170 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2026-03-27T08:25:36,172 [^1]: For Python, any directory (with suitable naming) can be imported, 2026-03-27T08:25:36,172 even if it does not contain any `.py` files. 2026-03-27T08:25:36,173 On the other hand, currently there is no concept of package data 2026-03-27T08:25:36,173 directory, all directories are treated like packages. 2026-03-27T08:25:36,174 ******************************************************************************** 2026-03-27T08:25:36,175 !! 2026-03-27T08:25:36,175 check.warn(importable) 2026-03-27T08:25:36,176 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:215: _Warning: Package 'chemprop.nn' is absent from the `packages` configuration. 2026-03-27T08:25:36,176 !! 2026-03-27T08:25:36,177 ******************************************************************************** 2026-03-27T08:25:36,178 ############################ 2026-03-27T08:25:36,178 # Package would be ignored # 2026-03-27T08:25:36,179 ############################ 2026-03-27T08:25:36,179 Python recognizes 'chemprop.nn' as an importable package[^1], 2026-03-27T08:25:36,180 but it is absent from setuptools' `packages` configuration. 2026-03-27T08:25:36,181 This leads to an ambiguous overall configuration. If you want to distribute this 2026-03-27T08:25:36,181 package, please make sure that 'chemprop.nn' is explicitly added 2026-03-27T08:25:36,182 to the `packages` configuration field. 2026-03-27T08:25:36,183 Alternatively, you can also rely on setuptools' discovery methods 2026-03-27T08:25:36,184 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2026-03-27T08:25:36,184 instead of `find_packages(...)`/`find:`). 2026-03-27T08:25:36,185 You can read more about "package discovery" on setuptools documentation page: 2026-03-27T08:25:36,186 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2026-03-27T08:25:36,188 If you don't want 'chemprop.nn' to be distributed and are 2026-03-27T08:25:36,188 already explicitly excluding 'chemprop.nn' via 2026-03-27T08:25:36,189 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2026-03-27T08:25:36,189 you can try to use `exclude_package_data`, or `include-package-data=False` in 2026-03-27T08:25:36,190 combination with a more fine grained `package-data` configuration. 2026-03-27T08:25:36,191 You can read more about "package data files" on setuptools documentation page: 2026-03-27T08:25:36,192 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2026-03-27T08:25:36,194 [^1]: For Python, any directory (with suitable naming) can be imported, 2026-03-27T08:25:36,194 even if it does not contain any `.py` files. 2026-03-27T08:25:36,195 On the other hand, currently there is no concept of package data 2026-03-27T08:25:36,195 directory, all directories are treated like packages. 2026-03-27T08:25:36,196 ******************************************************************************** 2026-03-27T08:25:36,197 !! 2026-03-27T08:25:36,198 check.warn(importable) 2026-03-27T08:25:36,198 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:215: _Warning: Package 'chemprop.nn.message_passing' is absent from the `packages` configuration. 2026-03-27T08:25:36,199 !! 2026-03-27T08:25:36,200 ******************************************************************************** 2026-03-27T08:25:36,200 ############################ 2026-03-27T08:25:36,201 # Package would be ignored # 2026-03-27T08:25:36,202 ############################ 2026-03-27T08:25:36,202 Python recognizes 'chemprop.nn.message_passing' as an importable package[^1], 2026-03-27T08:25:36,203 but it is absent from setuptools' `packages` configuration. 2026-03-27T08:25:36,204 This leads to an ambiguous overall configuration. If you want to distribute this 2026-03-27T08:25:36,204 package, please make sure that 'chemprop.nn.message_passing' is explicitly added 2026-03-27T08:25:36,204 to the `packages` configuration field. 2026-03-27T08:25:36,206 Alternatively, you can also rely on setuptools' discovery methods 2026-03-27T08:25:36,206 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2026-03-27T08:25:36,206 instead of `find_packages(...)`/`find:`). 2026-03-27T08:25:36,207 You can read more about "package discovery" on setuptools documentation page: 2026-03-27T08:25:36,208 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2026-03-27T08:25:36,209 If you don't want 'chemprop.nn.message_passing' to be distributed and are 2026-03-27T08:25:36,210 already explicitly excluding 'chemprop.nn.message_passing' via 2026-03-27T08:25:36,210 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2026-03-27T08:25:36,211 you can try to use `exclude_package_data`, or `include-package-data=False` in 2026-03-27T08:25:36,211 combination with a more fine grained `package-data` configuration. 2026-03-27T08:25:36,212 You can read more about "package data files" on setuptools documentation page: 2026-03-27T08:25:36,213 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2026-03-27T08:25:36,215 [^1]: For Python, any directory (with suitable naming) can be imported, 2026-03-27T08:25:36,216 even if it does not contain any `.py` files. 2026-03-27T08:25:36,217 On the other hand, currently there is no concept of package data 2026-03-27T08:25:36,217 directory, all directories are treated like packages. 2026-03-27T08:25:36,218 ******************************************************************************** 2026-03-27T08:25:36,219 !! 2026-03-27T08:25:36,220 check.warn(importable) 2026-03-27T08:25:36,220 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:215: _Warning: Package 'chemprop.uncertainty' is absent from the `packages` configuration. 2026-03-27T08:25:36,221 !! 2026-03-27T08:25:36,222 ******************************************************************************** 2026-03-27T08:25:36,223 ############################ 2026-03-27T08:25:36,223 # Package would be ignored # 2026-03-27T08:25:36,224 ############################ 2026-03-27T08:25:36,224 Python recognizes 'chemprop.uncertainty' as an importable package[^1], 2026-03-27T08:25:36,225 but it is absent from setuptools' `packages` configuration. 2026-03-27T08:25:36,226 This leads to an ambiguous overall configuration. If you want to distribute this 2026-03-27T08:25:36,226 package, please make sure that 'chemprop.uncertainty' is explicitly added 2026-03-27T08:25:36,227 to the `packages` configuration field. 2026-03-27T08:25:36,228 Alternatively, you can also rely on setuptools' discovery methods 2026-03-27T08:25:36,228 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2026-03-27T08:25:36,229 instead of `find_packages(...)`/`find:`). 2026-03-27T08:25:36,230 You can read more about "package discovery" on setuptools documentation page: 2026-03-27T08:25:36,231 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2026-03-27T08:25:36,233 If you don't want 'chemprop.uncertainty' to be distributed and are 2026-03-27T08:25:36,233 already explicitly excluding 'chemprop.uncertainty' via 2026-03-27T08:25:36,234 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2026-03-27T08:25:36,234 you can try to use `exclude_package_data`, or `include-package-data=False` in 2026-03-27T08:25:36,235 combination with a more fine grained `package-data` configuration. 2026-03-27T08:25:36,236 You can read more about "package data files" on setuptools documentation page: 2026-03-27T08:25:36,237 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2026-03-27T08:25:36,238 [^1]: For Python, any directory (with suitable naming) can be imported, 2026-03-27T08:25:36,239 even if it does not contain any `.py` files. 2026-03-27T08:25:36,239 On the other hand, currently there is no concept of package data 2026-03-27T08:25:36,240 directory, all directories are treated like packages. 2026-03-27T08:25:36,240 ******************************************************************************** 2026-03-27T08:25:36,241 !! 2026-03-27T08:25:36,242 check.warn(importable) 2026-03-27T08:25:36,242 /tmp/pip-build-env-___71mer/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:215: _Warning: Package 'chemprop.utils' is absent from the `packages` configuration. 2026-03-27T08:25:36,243 !! 2026-03-27T08:25:36,244 ******************************************************************************** 2026-03-27T08:25:36,244 ############################ 2026-03-27T08:25:36,245 # Package would be ignored # 2026-03-27T08:25:36,246 ############################ 2026-03-27T08:25:36,246 Python recognizes 'chemprop.utils' as an importable package[^1], 2026-03-27T08:25:36,247 but it is absent from setuptools' `packages` configuration. 2026-03-27T08:25:36,248 This leads to an ambiguous overall configuration. If you want to distribute this 2026-03-27T08:25:36,249 package, please make sure that 'chemprop.utils' is explicitly added 2026-03-27T08:25:36,249 to the `packages` configuration field. 2026-03-27T08:25:36,250 Alternatively, you can also rely on setuptools' discovery methods 2026-03-27T08:25:36,251 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2026-03-27T08:25:36,252 instead of `find_packages(...)`/`find:`). 2026-03-27T08:25:36,253 You can read more about "package discovery" on setuptools documentation page: 2026-03-27T08:25:36,254 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2026-03-27T08:25:36,255 If you don't want 'chemprop.utils' to be distributed and are 2026-03-27T08:25:36,256 already explicitly excluding 'chemprop.utils' via 2026-03-27T08:25:36,256 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2026-03-27T08:25:36,257 you can try to use `exclude_package_data`, or `include-package-data=False` in 2026-03-27T08:25:36,257 combination with a more fine grained `package-data` configuration. 2026-03-27T08:25:36,258 You can read more about "package data files" on setuptools documentation page: 2026-03-27T08:25:36,259 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2026-03-27T08:25:36,261 [^1]: For Python, any directory (with suitable naming) can be imported, 2026-03-27T08:25:36,261 even if it does not contain any `.py` files. 2026-03-27T08:25:36,262 On the other hand, currently there is no concept of package data 2026-03-27T08:25:36,263 directory, all directories are treated like packages. 2026-03-27T08:25:36,263 ******************************************************************************** 2026-03-27T08:25:36,264 !! 2026-03-27T08:25:36,265 check.warn(importable) 2026-03-27T08:25:36,265 creating build/lib/chemprop/cli 2026-03-27T08:25:36,265 copying chemprop/cli/common.py -> build/lib/chemprop/cli 2026-03-27T08:25:36,266 copying chemprop/cli/conf.py -> build/lib/chemprop/cli 2026-03-27T08:25:36,266 copying chemprop/cli/convert.py -> build/lib/chemprop/cli 2026-03-27T08:25:36,267 copying chemprop/cli/fingerprint.py -> build/lib/chemprop/cli 2026-03-27T08:25:36,267 copying chemprop/cli/hpopt.py -> build/lib/chemprop/cli 2026-03-27T08:25:36,267 copying chemprop/cli/main.py -> build/lib/chemprop/cli 2026-03-27T08:25:36,268 copying chemprop/cli/predict.py -> build/lib/chemprop/cli 2026-03-27T08:25:36,268 copying chemprop/cli/train.py -> build/lib/chemprop/cli 2026-03-27T08:25:36,269 creating build/lib/chemprop/cli/utils 2026-03-27T08:25:36,269 copying chemprop/cli/utils/MAB_parsing.py -> build/lib/chemprop/cli/utils 2026-03-27T08:25:36,270 copying chemprop/cli/utils/__init__.py -> build/lib/chemprop/cli/utils 2026-03-27T08:25:36,270 copying chemprop/cli/utils/actions.py -> build/lib/chemprop/cli/utils 2026-03-27T08:25:36,271 copying chemprop/cli/utils/args.py -> build/lib/chemprop/cli/utils 2026-03-27T08:25:36,271 copying chemprop/cli/utils/command.py -> build/lib/chemprop/cli/utils 2026-03-27T08:25:36,271 copying chemprop/cli/utils/parsing.py -> build/lib/chemprop/cli/utils 2026-03-27T08:25:36,272 copying chemprop/cli/utils/utils.py -> build/lib/chemprop/cli/utils 2026-03-27T08:25:36,272 creating build/lib/chemprop/data 2026-03-27T08:25:36,273 copying chemprop/data/__init__.py -> build/lib/chemprop/data 2026-03-27T08:25:36,273 copying chemprop/data/collate.py -> build/lib/chemprop/data 2026-03-27T08:25:36,274 copying chemprop/data/dataloader.py -> build/lib/chemprop/data 2026-03-27T08:25:36,274 copying chemprop/data/datapoints.py -> build/lib/chemprop/data 2026-03-27T08:25:36,274 copying chemprop/data/datasets.py -> build/lib/chemprop/data 2026-03-27T08:25:36,275 copying chemprop/data/molgraph.py -> build/lib/chemprop/data 2026-03-27T08:25:36,275 copying chemprop/data/samplers.py -> build/lib/chemprop/data 2026-03-27T08:25:36,276 copying chemprop/data/splitting.py -> build/lib/chemprop/data 2026-03-27T08:25:36,276 creating build/lib/chemprop/featurizers 2026-03-27T08:25:36,277 copying chemprop/featurizers/__init__.py -> build/lib/chemprop/featurizers 2026-03-27T08:25:36,277 copying chemprop/featurizers/atom.py -> build/lib/chemprop/featurizers 2026-03-27T08:25:36,278 copying chemprop/featurizers/base.py -> build/lib/chemprop/featurizers 2026-03-27T08:25:36,278 copying chemprop/featurizers/bond.py -> build/lib/chemprop/featurizers 2026-03-27T08:25:36,279 copying chemprop/featurizers/molecule.py -> build/lib/chemprop/featurizers 2026-03-27T08:25:36,279 creating build/lib/chemprop/featurizers/molgraph 2026-03-27T08:25:36,280 copying chemprop/featurizers/molgraph/__init__.py -> build/lib/chemprop/featurizers/molgraph 2026-03-27T08:25:36,280 copying chemprop/featurizers/molgraph/cache.py -> build/lib/chemprop/featurizers/molgraph 2026-03-27T08:25:36,281 copying chemprop/featurizers/molgraph/mixins.py -> build/lib/chemprop/featurizers/molgraph 2026-03-27T08:25:36,281 copying chemprop/featurizers/molgraph/molecule.py -> build/lib/chemprop/featurizers/molgraph 2026-03-27T08:25:36,282 copying chemprop/featurizers/molgraph/reaction.py -> build/lib/chemprop/featurizers/molgraph 2026-03-27T08:25:36,282 creating build/lib/chemprop/models 2026-03-27T08:25:36,283 copying chemprop/models/__init__.py -> build/lib/chemprop/models 2026-03-27T08:25:36,284 copying chemprop/models/model.py -> build/lib/chemprop/models 2026-03-27T08:25:36,284 copying chemprop/models/mol_atom_bond.py -> build/lib/chemprop/models 2026-03-27T08:25:36,285 copying chemprop/models/multi.py -> build/lib/chemprop/models 2026-03-27T08:25:36,285 copying chemprop/models/utils.py -> build/lib/chemprop/models 2026-03-27T08:25:36,286 creating build/lib/chemprop/nn 2026-03-27T08:25:36,286 copying chemprop/nn/__init__.py -> build/lib/chemprop/nn 2026-03-27T08:25:36,287 copying chemprop/nn/agg.py -> build/lib/chemprop/nn 2026-03-27T08:25:36,288 copying chemprop/nn/ffn.py -> build/lib/chemprop/nn 2026-03-27T08:25:36,288 copying chemprop/nn/hparams.py -> build/lib/chemprop/nn 2026-03-27T08:25:36,289 copying chemprop/nn/metrics.py -> build/lib/chemprop/nn 2026-03-27T08:25:36,289 copying chemprop/nn/predictors.py -> build/lib/chemprop/nn 2026-03-27T08:25:36,290 copying chemprop/nn/transforms.py -> build/lib/chemprop/nn 2026-03-27T08:25:36,290 copying chemprop/nn/utils.py -> build/lib/chemprop/nn 2026-03-27T08:25:36,291 creating build/lib/chemprop/nn/message_passing 2026-03-27T08:25:36,291 copying chemprop/nn/message_passing/__init__.py -> build/lib/chemprop/nn/message_passing 2026-03-27T08:25:36,292 copying chemprop/nn/message_passing/base.py -> build/lib/chemprop/nn/message_passing 2026-03-27T08:25:36,292 copying chemprop/nn/message_passing/mixins.py -> build/lib/chemprop/nn/message_passing 2026-03-27T08:25:36,293 copying chemprop/nn/message_passing/mol_atom_bond.py -> build/lib/chemprop/nn/message_passing 2026-03-27T08:25:36,293 copying chemprop/nn/message_passing/multi.py -> build/lib/chemprop/nn/message_passing 2026-03-27T08:25:36,294 copying chemprop/nn/message_passing/proto.py -> build/lib/chemprop/nn/message_passing 2026-03-27T08:25:36,294 creating build/lib/chemprop/uncertainty 2026-03-27T08:25:36,295 copying chemprop/uncertainty/__init__.py -> build/lib/chemprop/uncertainty 2026-03-27T08:25:36,295 copying chemprop/uncertainty/calibrator.py -> build/lib/chemprop/uncertainty 2026-03-27T08:25:36,296 copying chemprop/uncertainty/estimator.py -> build/lib/chemprop/uncertainty 2026-03-27T08:25:36,296 copying chemprop/uncertainty/evaluator.py -> build/lib/chemprop/uncertainty 2026-03-27T08:25:36,297 creating build/lib/chemprop/utils 2026-03-27T08:25:36,297 copying chemprop/utils/__init__.py -> build/lib/chemprop/utils 2026-03-27T08:25:36,298 copying chemprop/utils/registry.py -> build/lib/chemprop/utils 2026-03-27T08:25:36,298 copying chemprop/utils/utils.py -> build/lib/chemprop/utils 2026-03-27T08:25:36,299 copying chemprop/utils/v1_to_v2.py -> build/lib/chemprop/utils 2026-03-27T08:25:36,299 copying chemprop/utils/v2_0_to_v2_1.py -> build/lib/chemprop/utils 2026-03-27T08:25:36,300 installing to build/bdist.linux-armv7l/wheel 2026-03-27T08:25:36,300 running install 2026-03-27T08:25:36,301 running install_lib 2026-03-27T08:25:36,301 creating build/bdist.linux-armv7l/wheel 2026-03-27T08:25:36,302 creating build/bdist.linux-armv7l/wheel/chemprop 2026-03-27T08:25:36,302 creating build/bdist.linux-armv7l/wheel/chemprop/models 2026-03-27T08:25:36,303 copying build/lib/chemprop/models/mol_atom_bond.py -> build/bdist.linux-armv7l/wheel/./chemprop/models 2026-03-27T08:25:36,303 copying build/lib/chemprop/models/model.py -> build/bdist.linux-armv7l/wheel/./chemprop/models 2026-03-27T08:25:36,304 copying build/lib/chemprop/models/__init__.py -> build/bdist.linux-armv7l/wheel/./chemprop/models 2026-03-27T08:25:36,304 copying build/lib/chemprop/models/multi.py -> build/bdist.linux-armv7l/wheel/./chemprop/models 2026-03-27T08:25:36,305 copying build/lib/chemprop/models/utils.py -> build/bdist.linux-armv7l/wheel/./chemprop/models 2026-03-27T08:25:36,305 creating build/bdist.linux-armv7l/wheel/chemprop/nn 2026-03-27T08:25:36,306 creating build/bdist.linux-armv7l/wheel/chemprop/nn/message_passing 2026-03-27T08:25:36,307 copying build/lib/chemprop/nn/message_passing/base.py -> build/bdist.linux-armv7l/wheel/./chemprop/nn/message_passing 2026-03-27T08:25:36,310 copying build/lib/chemprop/nn/message_passing/proto.py -> build/bdist.linux-armv7l/wheel/./chemprop/nn/message_passing 2026-03-27T08:25:36,312 copying build/lib/chemprop/nn/message_passing/mol_atom_bond.py -> build/bdist.linux-armv7l/wheel/./chemprop/nn/message_passing 2026-03-27T08:25:36,314 copying build/lib/chemprop/nn/message_passing/mixins.py -> build/bdist.linux-armv7l/wheel/./chemprop/nn/message_passing 2026-03-27T08:25:36,316 copying build/lib/chemprop/nn/message_passing/__init__.py -> build/bdist.linux-armv7l/wheel/./chemprop/nn/message_passing 2026-03-27T08:25:36,318 copying build/lib/chemprop/nn/message_passing/multi.py -> build/bdist.linux-armv7l/wheel/./chemprop/nn/message_passing 2026-03-27T08:25:36,320 copying build/lib/chemprop/nn/metrics.py -> build/bdist.linux-armv7l/wheel/./chemprop/nn 2026-03-27T08:25:36,322 copying build/lib/chemprop/nn/transforms.py -> build/bdist.linux-armv7l/wheel/./chemprop/nn 2026-03-27T08:25:36,324 copying build/lib/chemprop/nn/predictors.py -> build/bdist.linux-armv7l/wheel/./chemprop/nn 2026-03-27T08:25:36,326 copying build/lib/chemprop/nn/ffn.py -> build/bdist.linux-armv7l/wheel/./chemprop/nn 2026-03-27T08:25:36,328 copying build/lib/chemprop/nn/__init__.py -> build/bdist.linux-armv7l/wheel/./chemprop/nn 2026-03-27T08:25:36,330 copying build/lib/chemprop/nn/agg.py -> build/bdist.linux-armv7l/wheel/./chemprop/nn 2026-03-27T08:25:36,332 copying build/lib/chemprop/nn/hparams.py -> build/bdist.linux-armv7l/wheel/./chemprop/nn 2026-03-27T08:25:36,333 copying build/lib/chemprop/nn/utils.py -> build/bdist.linux-armv7l/wheel/./chemprop/nn 2026-03-27T08:25:36,335 copying build/lib/chemprop/schedulers.py -> build/bdist.linux-armv7l/wheel/./chemprop 2026-03-27T08:25:36,337 creating build/bdist.linux-armv7l/wheel/chemprop/cli 2026-03-27T08:25:36,338 copying build/lib/chemprop/cli/hpopt.py -> build/bdist.linux-armv7l/wheel/./chemprop/cli 2026-03-27T08:25:36,341 copying build/lib/chemprop/cli/convert.py -> build/bdist.linux-armv7l/wheel/./chemprop/cli 2026-03-27T08:25:36,343 copying build/lib/chemprop/cli/fingerprint.py -> build/bdist.linux-armv7l/wheel/./chemprop/cli 2026-03-27T08:25:36,345 copying build/lib/chemprop/cli/common.py -> build/bdist.linux-armv7l/wheel/./chemprop/cli 2026-03-27T08:25:36,347 copying build/lib/chemprop/cli/predict.py -> build/bdist.linux-armv7l/wheel/./chemprop/cli 2026-03-27T08:25:36,350 copying build/lib/chemprop/cli/main.py -> build/bdist.linux-armv7l/wheel/./chemprop/cli 2026-03-27T08:25:36,353 creating build/bdist.linux-armv7l/wheel/chemprop/cli/utils 2026-03-27T08:25:36,354 copying build/lib/chemprop/cli/utils/args.py -> build/bdist.linux-armv7l/wheel/./chemprop/cli/utils 2026-03-27T08:25:36,356 copying build/lib/chemprop/cli/utils/MAB_parsing.py -> build/bdist.linux-armv7l/wheel/./chemprop/cli/utils 2026-03-27T08:25:36,358 copying build/lib/chemprop/cli/utils/__init__.py -> build/bdist.linux-armv7l/wheel/./chemprop/cli/utils 2026-03-27T08:25:36,359 copying build/lib/chemprop/cli/utils/command.py -> build/bdist.linux-armv7l/wheel/./chemprop/cli/utils 2026-03-27T08:25:36,361 copying build/lib/chemprop/cli/utils/actions.py -> build/bdist.linux-armv7l/wheel/./chemprop/cli/utils 2026-03-27T08:25:36,363 copying build/lib/chemprop/cli/utils/utils.py -> build/bdist.linux-armv7l/wheel/./chemprop/cli/utils 2026-03-27T08:25:36,365 copying build/lib/chemprop/cli/utils/parsing.py -> build/bdist.linux-armv7l/wheel/./chemprop/cli/utils 2026-03-27T08:25:36,367 copying build/lib/chemprop/cli/conf.py -> build/bdist.linux-armv7l/wheel/./chemprop/cli 2026-03-27T08:25:36,369 copying build/lib/chemprop/cli/train.py -> build/bdist.linux-armv7l/wheel/./chemprop/cli 2026-03-27T08:25:36,373 copying build/lib/chemprop/types.py -> build/bdist.linux-armv7l/wheel/./chemprop 2026-03-27T08:25:36,375 copying build/lib/chemprop/exceptions.py -> build/bdist.linux-armv7l/wheel/./chemprop 2026-03-27T08:25:36,377 creating build/bdist.linux-armv7l/wheel/chemprop/utils 2026-03-27T08:25:36,378 copying build/lib/chemprop/utils/v1_to_v2.py -> build/bdist.linux-armv7l/wheel/./chemprop/utils 2026-03-27T08:25:36,380 copying build/lib/chemprop/utils/__init__.py -> build/bdist.linux-armv7l/wheel/./chemprop/utils 2026-03-27T08:25:36,382 copying build/lib/chemprop/utils/registry.py -> build/bdist.linux-armv7l/wheel/./chemprop/utils 2026-03-27T08:25:36,384 copying build/lib/chemprop/utils/v2_0_to_v2_1.py -> build/bdist.linux-armv7l/wheel/./chemprop/utils 2026-03-27T08:25:36,386 copying build/lib/chemprop/utils/utils.py -> build/bdist.linux-armv7l/wheel/./chemprop/utils 2026-03-27T08:25:36,389 creating build/bdist.linux-armv7l/wheel/chemprop/featurizers 2026-03-27T08:25:36,390 creating build/bdist.linux-armv7l/wheel/chemprop/featurizers/molgraph 2026-03-27T08:25:36,391 copying build/lib/chemprop/featurizers/molgraph/mixins.py -> build/bdist.linux-armv7l/wheel/./chemprop/featurizers/molgraph 2026-03-27T08:25:36,393 copying build/lib/chemprop/featurizers/molgraph/cache.py -> build/bdist.linux-armv7l/wheel/./chemprop/featurizers/molgraph 2026-03-27T08:25:36,395 copying build/lib/chemprop/featurizers/molgraph/molecule.py -> build/bdist.linux-armv7l/wheel/./chemprop/featurizers/molgraph 2026-03-27T08:25:36,397 copying build/lib/chemprop/featurizers/molgraph/__init__.py -> build/bdist.linux-armv7l/wheel/./chemprop/featurizers/molgraph 2026-03-27T08:25:36,399 copying build/lib/chemprop/featurizers/molgraph/reaction.py -> build/bdist.linux-armv7l/wheel/./chemprop/featurizers/molgraph 2026-03-27T08:25:36,401 copying build/lib/chemprop/featurizers/base.py -> build/bdist.linux-armv7l/wheel/./chemprop/featurizers 2026-03-27T08:25:36,403 copying build/lib/chemprop/featurizers/atom.py -> build/bdist.linux-armv7l/wheel/./chemprop/featurizers 2026-03-27T08:25:36,405 copying build/lib/chemprop/featurizers/molecule.py -> build/bdist.linux-armv7l/wheel/./chemprop/featurizers 2026-03-27T08:25:36,406 copying build/lib/chemprop/featurizers/__init__.py -> build/bdist.linux-armv7l/wheel/./chemprop/featurizers 2026-03-27T08:25:36,408 copying build/lib/chemprop/featurizers/bond.py -> build/bdist.linux-armv7l/wheel/./chemprop/featurizers 2026-03-27T08:25:36,410 copying build/lib/chemprop/__init__.py -> build/bdist.linux-armv7l/wheel/./chemprop 2026-03-27T08:25:36,412 copying build/lib/chemprop/conf.py -> build/bdist.linux-armv7l/wheel/./chemprop 2026-03-27T08:25:36,414 creating build/bdist.linux-armv7l/wheel/chemprop/uncertainty 2026-03-27T08:25:36,415 copying build/lib/chemprop/uncertainty/evaluator.py -> build/bdist.linux-armv7l/wheel/./chemprop/uncertainty 2026-03-27T08:25:36,417 copying build/lib/chemprop/uncertainty/estimator.py -> build/bdist.linux-armv7l/wheel/./chemprop/uncertainty 2026-03-27T08:25:36,420 copying build/lib/chemprop/uncertainty/calibrator.py -> build/bdist.linux-armv7l/wheel/./chemprop/uncertainty 2026-03-27T08:25:36,423 copying build/lib/chemprop/uncertainty/__init__.py -> build/bdist.linux-armv7l/wheel/./chemprop/uncertainty 2026-03-27T08:25:36,426 creating build/bdist.linux-armv7l/wheel/chemprop/data 2026-03-27T08:25:36,427 copying build/lib/chemprop/data/datasets.py -> build/bdist.linux-armv7l/wheel/./chemprop/data 2026-03-27T08:25:36,430 copying build/lib/chemprop/data/dataloader.py -> build/bdist.linux-armv7l/wheel/./chemprop/data 2026-03-27T08:25:36,432 copying build/lib/chemprop/data/molgraph.py -> build/bdist.linux-armv7l/wheel/./chemprop/data 2026-03-27T08:25:36,433 copying build/lib/chemprop/data/collate.py -> build/bdist.linux-armv7l/wheel/./chemprop/data 2026-03-27T08:25:36,436 copying build/lib/chemprop/data/datapoints.py -> build/bdist.linux-armv7l/wheel/./chemprop/data 2026-03-27T08:25:36,438 copying build/lib/chemprop/data/__init__.py -> build/bdist.linux-armv7l/wheel/./chemprop/data 2026-03-27T08:25:36,440 copying build/lib/chemprop/data/samplers.py -> build/bdist.linux-armv7l/wheel/./chemprop/data 2026-03-27T08:25:36,442 copying build/lib/chemprop/data/splitting.py -> build/bdist.linux-armv7l/wheel/./chemprop/data 2026-03-27T08:25:36,444 running install_egg_info 2026-03-27T08:25:36,450 Copying chemprop.egg-info to build/bdist.linux-armv7l/wheel/./chemprop-2.2.3-py3.11.egg-info 2026-03-27T08:25:36,462 running install_scripts 2026-03-27T08:25:36,474 creating build/bdist.linux-armv7l/wheel/chemprop-2.2.3.dist-info/WHEEL 2026-03-27T08:25:36,477 creating '/tmp/pip-wheel-j4hn3r_e/.tmp-ke1jcv2f/chemprop-2.2.3-py3-none-any.whl' and adding 'build/bdist.linux-armv7l/wheel' to it 2026-03-27T08:25:36,480 adding 'chemprop/__init__.py' 2026-03-27T08:25:36,481 adding 'chemprop/conf.py' 2026-03-27T08:25:36,482 adding 'chemprop/exceptions.py' 2026-03-27T08:25:36,483 adding 'chemprop/schedulers.py' 2026-03-27T08:25:36,484 adding 'chemprop/types.py' 2026-03-27T08:25:36,487 adding 'chemprop/cli/common.py' 2026-03-27T08:25:36,488 adding 'chemprop/cli/conf.py' 2026-03-27T08:25:36,490 adding 'chemprop/cli/convert.py' 2026-03-27T08:25:36,492 adding 'chemprop/cli/fingerprint.py' 2026-03-27T08:25:36,495 adding 'chemprop/cli/hpopt.py' 2026-03-27T08:25:36,496 adding 'chemprop/cli/main.py' 2026-03-27T08:25:36,500 adding 'chemprop/cli/predict.py' 2026-03-27T08:25:36,510 adding 'chemprop/cli/train.py' 2026-03-27T08:25:36,513 adding 'chemprop/cli/utils/MAB_parsing.py' 2026-03-27T08:25:36,515 adding 'chemprop/cli/utils/__init__.py' 2026-03-27T08:25:36,516 adding 'chemprop/cli/utils/actions.py' 2026-03-27T08:25:36,517 adding 'chemprop/cli/utils/args.py' 2026-03-27T08:25:36,518 adding 'chemprop/cli/utils/command.py' 2026-03-27T08:25:36,521 adding 'chemprop/cli/utils/parsing.py' 2026-03-27T08:25:36,522 adding 'chemprop/cli/utils/utils.py' 2026-03-27T08:25:36,524 adding 'chemprop/data/__init__.py' 2026-03-27T08:25:36,525 adding 'chemprop/data/collate.py' 2026-03-27T08:25:36,526 adding 'chemprop/data/dataloader.py' 2026-03-27T08:25:36,528 adding 'chemprop/data/datapoints.py' 2026-03-27T08:25:36,531 adding 'chemprop/data/datasets.py' 2026-03-27T08:25:36,532 adding 'chemprop/data/molgraph.py' 2026-03-27T08:25:36,533 adding 'chemprop/data/samplers.py' 2026-03-27T08:25:36,535 adding 'chemprop/data/splitting.py' 2026-03-27T08:25:36,537 adding 'chemprop/featurizers/__init__.py' 2026-03-27T08:25:36,538 adding 'chemprop/featurizers/atom.py' 2026-03-27T08:25:36,540 adding 'chemprop/featurizers/base.py' 2026-03-27T08:25:36,541 adding 'chemprop/featurizers/bond.py' 2026-03-27T08:25:36,542 adding 'chemprop/featurizers/molecule.py' 2026-03-27T08:25:36,544 adding 'chemprop/featurizers/molgraph/__init__.py' 2026-03-27T08:25:36,546 adding 'chemprop/featurizers/molgraph/cache.py' 2026-03-27T08:25:36,547 adding 'chemprop/featurizers/molgraph/mixins.py' 2026-03-27T08:25:36,549 adding 'chemprop/featurizers/molgraph/molecule.py' 2026-03-27T08:25:36,551 adding 'chemprop/featurizers/molgraph/reaction.py' 2026-03-27T08:25:36,552 adding 'chemprop/models/__init__.py' 2026-03-27T08:25:36,554 adding 'chemprop/models/model.py' 2026-03-27T08:25:36,557 adding 'chemprop/models/mol_atom_bond.py' 2026-03-27T08:25:36,558 adding 'chemprop/models/multi.py' 2026-03-27T08:25:36,560 adding 'chemprop/models/utils.py' 2026-03-27T08:25:36,562 adding 'chemprop/nn/__init__.py' 2026-03-27T08:25:36,563 adding 'chemprop/nn/agg.py' 2026-03-27T08:25:36,565 adding 'chemprop/nn/ffn.py' 2026-03-27T08:25:36,566 adding 'chemprop/nn/hparams.py' 2026-03-27T08:25:36,569 adding 'chemprop/nn/metrics.py' 2026-03-27T08:25:36,571 adding 'chemprop/nn/predictors.py' 2026-03-27T08:25:36,572 adding 'chemprop/nn/transforms.py' 2026-03-27T08:25:36,573 adding 'chemprop/nn/utils.py' 2026-03-27T08:25:36,575 adding 'chemprop/nn/message_passing/__init__.py' 2026-03-27T08:25:36,577 adding 'chemprop/nn/message_passing/base.py' 2026-03-27T08:25:36,578 adding 'chemprop/nn/message_passing/mixins.py' 2026-03-27T08:25:36,580 adding 'chemprop/nn/message_passing/mol_atom_bond.py' 2026-03-27T08:25:36,582 adding 'chemprop/nn/message_passing/multi.py' 2026-03-27T08:25:36,583 adding 'chemprop/nn/message_passing/proto.py' 2026-03-27T08:25:36,585 adding 'chemprop/uncertainty/__init__.py' 2026-03-27T08:25:36,588 adding 'chemprop/uncertainty/calibrator.py' 2026-03-27T08:25:36,591 adding 'chemprop/uncertainty/estimator.py' 2026-03-27T08:25:36,594 adding 'chemprop/uncertainty/evaluator.py' 2026-03-27T08:25:36,595 adding 'chemprop/utils/__init__.py' 2026-03-27T08:25:36,597 adding 'chemprop/utils/registry.py' 2026-03-27T08:25:36,598 adding 'chemprop/utils/utils.py' 2026-03-27T08:25:36,600 adding 'chemprop/utils/v1_to_v2.py' 2026-03-27T08:25:36,601 adding 'chemprop/utils/v2_0_to_v2_1.py' 2026-03-27T08:25:36,604 adding 'chemprop-2.2.3.dist-info/licenses/LICENSE.txt' 2026-03-27T08:25:36,606 adding 'chemprop-2.2.3.dist-info/METADATA' 2026-03-27T08:25:36,607 adding 'chemprop-2.2.3.dist-info/WHEEL' 2026-03-27T08:25:36,608 adding 'chemprop-2.2.3.dist-info/entry_points.txt' 2026-03-27T08:25:36,608 adding 'chemprop-2.2.3.dist-info/top_level.txt' 2026-03-27T08:25:36,610 adding 'chemprop-2.2.3.dist-info/RECORD' 2026-03-27T08:25:36,613 removing build/bdist.linux-armv7l/wheel 2026-03-27T08:25:36,737 Building wheel for chemprop (pyproject.toml): finished with status 'done' 2026-03-27T08:25:36,745 Created wheel for chemprop: filename=chemprop-2.2.3-py3-none-any.whl size=148865 sha256=2fc74907a7ecb20036ae2182c4230cc454862d7fd47671c060b514016da5fdad 2026-03-27T08:25:36,746 Stored in directory: /tmp/pip-ephem-wheel-cache-du06wcsl/wheels/cb/f7/a8/1303fe0a41d458537d189adc79cdc8d7fe2e673074d4f124fa 2026-03-27T08:25:36,760 Successfully built chemprop 2026-03-27T08:25:36,767 Removed build tracker: '/tmp/pip-build-tracker-pnor7070'