2024-05-22T21:48:21,266 Created temporary directory: /tmp/pip-build-tracker-of83roey 2024-05-22T21:48:21,267 Initialized build tracking at /tmp/pip-build-tracker-of83roey 2024-05-22T21:48:21,267 Created build tracker: /tmp/pip-build-tracker-of83roey 2024-05-22T21:48:21,268 Entered build tracker: /tmp/pip-build-tracker-of83roey 2024-05-22T21:48:21,269 Created temporary directory: /tmp/pip-wheel-31blxqax 2024-05-22T21:48:21,271 Created temporary directory: /tmp/pip-ephem-wheel-cache-mucv61ii 2024-05-22T21:48:21,297 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-05-22T21:48:21,300 2 location(s) to search for versions of meeko: 2024-05-22T21:48:21,300 * https://pypi.org/simple/meeko/ 2024-05-22T21:48:21,300 * https://www.piwheels.org/simple/meeko/ 2024-05-22T21:48:21,301 Fetching project page and analyzing links: https://pypi.org/simple/meeko/ 2024-05-22T21:48:21,302 Getting page https://pypi.org/simple/meeko/ 2024-05-22T21:48:21,303 Found index url https://pypi.org/simple/ 2024-05-22T21:48:21,517 Fetched page https://pypi.org/simple/meeko/ as application/vnd.pypi.simple.v1+json 2024-05-22T21:48:21,523 Skipping link: No binaries permitted for meeko: https://files.pythonhosted.org/packages/38/c7/946dda1732a3aeca878b9cf1aa1a965066488479d67e4fc137d2379a79b6/meeko-0.1.dev1-py2.py3-none-any.whl (from https://pypi.org/simple/meeko/) (requires-python:>=3.5.*) 2024-05-22T21:48:21,524 Skipping link: No binaries permitted for meeko: https://files.pythonhosted.org/packages/61/30/79ecf599df2c81ead389544f3291774adddccb3ac4548eae61a7b8a62bc3/meeko-0.1.dev2-py2.py3-none-any.whl (from https://pypi.org/simple/meeko/) (requires-python:>=3.5.*) 2024-05-22T21:48:21,524 Skipping link: No binaries permitted for meeko: https://files.pythonhosted.org/packages/89/84/827a0ea853ba0970f0287eb09ba7d07186590a510d10a8b63a2d884ac447/meeko-0.1.dev3-py2.py3-none-any.whl (from https://pypi.org/simple/meeko/) (requires-python:>=3.5.*) 2024-05-22T21:48:21,525 Found link https://files.pythonhosted.org/packages/ec/d2/c1eaf8b818377fbe788daf86dc8994fcc4ae2d4b6fa00c2a5c81d8aa2ca6/meeko-0.1.dev3.tar.gz (from https://pypi.org/simple/meeko/) (requires-python:>=3.5.*), version: 0.1.dev3 2024-05-22T21:48:21,526 Skipping link: No binaries permitted for meeko: https://files.pythonhosted.org/packages/f1/b6/fe6205ca310917d121b6f96259c845d94ef627d7473fc2bd119235b5b8d3/meeko-0.2-py3-none-any.whl (from https://pypi.org/simple/meeko/) (requires-python:>=3.5.*) 2024-05-22T21:48:21,527 Found link https://files.pythonhosted.org/packages/23/24/36f5b53aa74cd50f5e6cea8d5d5f3b99b6f3ea1e2a059d13f5f8d51a0624/meeko-0.2.tar.gz (from https://pypi.org/simple/meeko/) (requires-python:>=3.5.*), version: 0.2 2024-05-22T21:48:21,528 Skipping link: No binaries permitted for meeko: https://files.pythonhosted.org/packages/15/e4/e0195c8d07d6c9226c9940ecb9164e6120e9502f64bee2a6303fb0a75ca1/meeko-0.3.0-py3-none-any.whl (from https://pypi.org/simple/meeko/) (requires-python:>=3.5.*) 2024-05-22T21:48:21,529 Found link https://files.pythonhosted.org/packages/1b/e5/ff954b3fbef337ac7cd0d29ebab8864385aad66fe528aae73d05604dddfd/meeko-0.3.0.tar.gz (from https://pypi.org/simple/meeko/) (requires-python:>=3.5.*), version: 0.3.0 2024-05-22T21:48:21,530 Skipping link: No binaries permitted for meeko: https://files.pythonhosted.org/packages/7a/ff/6e57ed90d6384e76ea2acb31a929f8f036468e07c80319764805398db9d8/meeko-0.3.1-py3-none-any.whl (from https://pypi.org/simple/meeko/) (requires-python:>=3.5.*) 2024-05-22T21:48:21,531 Found link https://files.pythonhosted.org/packages/33/b4/3a1d12da1c3bc0c7381c51aec8e51206f2b28b8c394b23cc4b373593c478/meeko-0.3.1.tar.gz (from https://pypi.org/simple/meeko/) (requires-python:>=3.5.*), version: 0.3.1 2024-05-22T21:48:21,532 Skipping link: No binaries permitted for meeko: https://files.pythonhosted.org/packages/1a/9d/28755e7eb7679082f4e00ef3e9ad3365e9f90c0d341e95289306a7d10831/meeko-0.3.2-py3-none-any.whl (from https://pypi.org/simple/meeko/) (requires-python:>=3.5.*) 2024-05-22T21:48:21,532 Found link https://files.pythonhosted.org/packages/04/fd/03d4d7fb97c6ce5789eea55cc8a5a27b3c9ba2e9e8944c46855d0356786d/meeko-0.3.2.tar.gz (from https://pypi.org/simple/meeko/) (requires-python:>=3.5.*), version: 0.3.2 2024-05-22T21:48:21,533 Skipping link: No binaries permitted for meeko: https://files.pythonhosted.org/packages/53/ae/fb019569a4c5d74bcd83434261e41b322aacfae687f38b1c8596c24be8b2/meeko-0.3.3-py3-none-any.whl (from https://pypi.org/simple/meeko/) (requires-python:>=3.5.*) 2024-05-22T21:48:21,535 Found link https://files.pythonhosted.org/packages/97/42/a9846a4bd8c90d8cf64857e183f3dc55f0553bad814a25ad9e454d51092b/meeko-0.3.3.tar.gz (from https://pypi.org/simple/meeko/) (requires-python:>=3.5.*), version: 0.3.3 2024-05-22T21:48:21,535 Skipping link: No binaries permitted for meeko: https://files.pythonhosted.org/packages/a1/38/e64382d54a507d7cd9b25472e91476d105e312ae8e3f88feacbd3ed6c4ca/meeko-0.4.0-py3-none-any.whl (from https://pypi.org/simple/meeko/) (requires-python:>=3.5.*) 2024-05-22T21:48:21,536 Found link https://files.pythonhosted.org/packages/df/e8/5599f1f3b4d82a6fd509e9ba1494866c9be26cb9cba57cffe433fb6573e1/meeko-0.4.0.tar.gz (from https://pypi.org/simple/meeko/) (requires-python:>=3.5.*), version: 0.4.0 2024-05-22T21:48:21,536 Skipping link: No binaries permitted for meeko: https://files.pythonhosted.org/packages/0f/97/aaae239d66f408f0d58c949bf4bc7c62add39fbf9ff22733fb087937ca82/meeko-0.5.0-py3-none-any.whl (from https://pypi.org/simple/meeko/) (requires-python:>=3.5) 2024-05-22T21:48:21,537 Found link https://files.pythonhosted.org/packages/78/17/8947c029c13d2f55f3a4833e17722dd275f94b10a7c32914374981eb8c8e/meeko-0.5.0.tar.gz (from https://pypi.org/simple/meeko/) (requires-python:>=3.5), version: 0.5.0 2024-05-22T21:48:21,538 Skipping link: No binaries permitted for meeko: https://files.pythonhosted.org/packages/e6/68/0fb8cfde91aac2fdb8377048043c70f1d7630bcdeb08398b0308c612ee53/meeko-0.5.1-py3-none-any.whl (from https://pypi.org/simple/meeko/) (requires-python:<3.12,>=3.5) 2024-05-22T21:48:21,539 Found link https://files.pythonhosted.org/packages/0f/cb/e51f5d788b046de6ddec15df59b455aef7c13914c5d2d5e519275ccf18a3/meeko-0.5.1.tar.gz (from https://pypi.org/simple/meeko/) (requires-python:<3.12,>=3.5), version: 0.5.1 2024-05-22T21:48:21,540 Skipping link: No binaries permitted for meeko: https://files.pythonhosted.org/packages/0f/93/453299cc4dca86c36c7eb9c35374078bfe1aa64a062d55d850286e73b083/meeko-0.6.0a0-py3-none-any.whl (from https://pypi.org/simple/meeko/) (requires-python:>=3.5) 2024-05-22T21:48:21,540 Found link https://files.pythonhosted.org/packages/17/d1/0906b1cb62d6d1bad1b7f1ab8d24d13fc7b8df66759ef4d0ce4fa4378de6/meeko-0.6.0a0.tar.gz (from https://pypi.org/simple/meeko/) (requires-python:>=3.5), version: 0.6.0a0 2024-05-22T21:48:21,541 Skipping link: No binaries permitted for meeko: https://files.pythonhosted.org/packages/0a/9f/774439a1db856b584ee216bea0e5319027518e7495bed613a65dbb960793/meeko-0.6.0a1-py3-none-any.whl (from https://pypi.org/simple/meeko/) (requires-python:>=3.5) 2024-05-22T21:48:21,542 Found link https://files.pythonhosted.org/packages/6e/0f/c39e837be0f4664bf9e3d9d139cbf5e1d2d836e671ca7769522eb5326a25/meeko-0.6.0a1.tar.gz (from https://pypi.org/simple/meeko/) (requires-python:>=3.5), version: 0.6.0a1 2024-05-22T21:48:21,543 Skipping link: No binaries permitted for meeko: https://files.pythonhosted.org/packages/3b/68/0733d4e5205baefc5484705710a8754117a50ca8acb4e1059b2908c38d4a/meeko-0.6.0a2-py3-none-any.whl (from https://pypi.org/simple/meeko/) (requires-python:>=3.5) 2024-05-22T21:48:21,544 Found link https://files.pythonhosted.org/packages/53/af/920d5c0225b08924a0c97746264ef33c4ba5d9622548e7b76e0a273e4999/meeko-0.6.0a2.tar.gz (from https://pypi.org/simple/meeko/) (requires-python:>=3.5), version: 0.6.0a2 2024-05-22T21:48:21,544 Skipping link: No binaries permitted for meeko: https://files.pythonhosted.org/packages/62/c9/674cb7336acafc89f9fbb77fd80311d57743d96cda81fdd62f6f99e35c31/meeko-0.6.0a3-py3-none-any.whl (from https://pypi.org/simple/meeko/) (requires-python:>=3.5) 2024-05-22T21:48:21,545 Found link https://files.pythonhosted.org/packages/a5/08/8abf3a5732e1c263114060366de04a76fde2c3ca6374e2fea80369e88194/meeko-0.6.0a3.tar.gz (from https://pypi.org/simple/meeko/) (requires-python:>=3.5), version: 0.6.0a3 2024-05-22T21:48:21,546 Fetching project page and analyzing links: https://www.piwheels.org/simple/meeko/ 2024-05-22T21:48:21,547 Getting page https://www.piwheels.org/simple/meeko/ 2024-05-22T21:48:21,548 Found index url https://www.piwheels.org/simple/ 2024-05-22T21:48:21,731 Fetched page https://www.piwheels.org/simple/meeko/ as text/html 2024-05-22T21:48:21,735 Skipping link: No binaries permitted for meeko: https://www.piwheels.org/simple/meeko/meeko-0.6.0a3-py3-none-any.whl#sha256=0a658b5458906667839e515e452caf347ab0cbc571061c216dabe7b4e54c6b3d (from https://www.piwheels.org/simple/meeko/) (requires-python:>=3.5) 2024-05-22T21:48:21,736 Skipping link: No binaries permitted for meeko: https://www.piwheels.org/simple/meeko/meeko-0.6.0a2-py3-none-any.whl#sha256=20994b5df8114eec204a0608030a8291e15c7a9214fdb1728b27489c3920027b (from https://www.piwheels.org/simple/meeko/) (requires-python:>=3.5) 2024-05-22T21:48:21,736 Skipping link: No binaries permitted for meeko: https://www.piwheels.org/simple/meeko/meeko-0.6.0a1-py3-none-any.whl#sha256=0ed52cfec48b37b3da175a1426f743aa6095efa144df31884f9cb86fb9fe40ad (from https://www.piwheels.org/simple/meeko/) (requires-python:>=3.5) 2024-05-22T21:48:21,737 Skipping link: No binaries permitted for meeko: https://www.piwheels.org/simple/meeko/meeko-0.6.0a0-py3-none-any.whl#sha256=b06250c9721d6cd2d9c001803a610364ce95f5084fded20180d0c25b77ef6b50 (from https://www.piwheels.org/simple/meeko/) (requires-python:>=3.5) 2024-05-22T21:48:21,737 Skipping link: No binaries permitted for meeko: https://www.piwheels.org/simple/meeko/meeko-0.5.0-py3-none-any.whl#sha256=716f47c9471895bb7314e06164f1748d2cb8f53987d8da9d52ec129b2c91cfc3 (from https://www.piwheels.org/simple/meeko/) (requires-python:>=3.5) 2024-05-22T21:48:21,738 Skipping link: No binaries permitted for meeko: https://www.piwheels.org/simple/meeko/meeko-0.4.0-py3-none-any.whl#sha256=ab401b9be3dd1941184d0ad836b51fc577db7d02d277f08ffc26285d54a6ee5e (from https://www.piwheels.org/simple/meeko/) (requires-python:>=3.5.*) 2024-05-22T21:48:21,738 Skipping link: No binaries permitted for meeko: https://www.piwheels.org/simple/meeko/meeko-0.3.3-py3-none-any.whl#sha256=f226db6d061657ac79463f4cc9b02ac1639cff39efeee9d289820c1fc6895382 (from https://www.piwheels.org/simple/meeko/) (requires-python:>=3.5.*) 2024-05-22T21:48:21,739 Skipping link: No binaries permitted for meeko: https://www.piwheels.org/simple/meeko/meeko-0.3.2-py3-none-any.whl#sha256=c36d011eb03705ad1d8fd598ce5e441b9c55c76b1c37011d95563b4fe5449494 (from https://www.piwheels.org/simple/meeko/) (requires-python:>=3.5.*) 2024-05-22T21:48:21,740 Skipping link: No binaries permitted for meeko: https://www.piwheels.org/simple/meeko/meeko-0.3.1-py3-none-any.whl#sha256=628a26bdbddab96cde118d3180a404144108c33edcbbefe3ade9e84f286cece0 (from https://www.piwheels.org/simple/meeko/) (requires-python:>=3.5.*) 2024-05-22T21:48:21,740 Skipping link: No binaries permitted for meeko: https://www.piwheels.org/simple/meeko/meeko-0.3.0-py3-none-any.whl#sha256=508ada8f77e474225a99c3905e6eb53c7db2a45a02c84a774d9f78a889a8da1d (from https://www.piwheels.org/simple/meeko/) (requires-python:>=3.5.*) 2024-05-22T21:48:21,741 Skipping link: No binaries permitted for meeko: https://www.piwheels.org/simple/meeko/meeko-0.2-py3-none-any.whl#sha256=88c75d8ed22efc73b451ac641472aa931ccbf3ef36f2f236c14a2d45d58541b2 (from https://www.piwheels.org/simple/meeko/) (requires-python:>=3.5.*) 2024-05-22T21:48:21,741 Skipping link: No binaries permitted for meeko: https://www.piwheels.org/simple/meeko/meeko-0.1.dev3-py2.py3-none-any.whl#sha256=feb4d48b05302efc1168ac2365ebfa920dd98fe24fca3f5cafe60376ed796caa (from https://www.piwheels.org/simple/meeko/) (requires-python:>=3.5.*) 2024-05-22T21:48:21,742 Skipping link: not a file: https://www.piwheels.org/simple/meeko/ 2024-05-22T21:48:21,743 Skipping link: not a file: https://pypi.org/simple/meeko/ 2024-05-22T21:48:21,762 Given no hashes to check 1 links for project 'meeko': discarding no candidates 2024-05-22T21:48:21,780 Collecting meeko==0.5.1 2024-05-22T21:48:21,782 Created temporary directory: /tmp/pip-unpack-uikwbkpm 2024-05-22T21:48:22,083 Downloading meeko-0.5.1.tar.gz (125 kB) 2024-05-22T21:48:22,313 Added meeko==0.5.1 from https://files.pythonhosted.org/packages/0f/cb/e51f5d788b046de6ddec15df59b455aef7c13914c5d2d5e519275ccf18a3/meeko-0.5.1.tar.gz to build tracker '/tmp/pip-build-tracker-of83roey' 2024-05-22T21:48:22,315 Running setup.py (path:/tmp/pip-wheel-31blxqax/meeko_f4081b9fdc4245e992cde42d1db284d2/setup.py) egg_info for package meeko 2024-05-22T21:48:22,316 Created temporary directory: /tmp/pip-pip-egg-info-edr3wkfy 2024-05-22T21:48:22,316 Preparing metadata (setup.py): started 2024-05-22T21:48:22,317 Running command python setup.py egg_info 2024-05-22T21:48:23,443 running egg_info 2024-05-22T21:48:23,448 creating /tmp/pip-pip-egg-info-edr3wkfy/meeko.egg-info 2024-05-22T21:48:23,479 writing /tmp/pip-pip-egg-info-edr3wkfy/meeko.egg-info/PKG-INFO 2024-05-22T21:48:23,486 writing dependency_links to /tmp/pip-pip-egg-info-edr3wkfy/meeko.egg-info/dependency_links.txt 2024-05-22T21:48:23,487 writing entry points to /tmp/pip-pip-egg-info-edr3wkfy/meeko.egg-info/entry_points.txt 2024-05-22T21:48:23,489 writing requirements to /tmp/pip-pip-egg-info-edr3wkfy/meeko.egg-info/requires.txt 2024-05-22T21:48:23,489 writing top-level names to /tmp/pip-pip-egg-info-edr3wkfy/meeko.egg-info/top_level.txt 2024-05-22T21:48:23,491 writing manifest file '/tmp/pip-pip-egg-info-edr3wkfy/meeko.egg-info/SOURCES.txt' 2024-05-22T21:48:23,582 reading manifest file '/tmp/pip-pip-egg-info-edr3wkfy/meeko.egg-info/SOURCES.txt' 2024-05-22T21:48:23,583 reading manifest template 'MANIFEST.in' 2024-05-22T21:48:23,586 warning: no files found matching 'example/*' 2024-05-22T21:48:23,589 adding license file 'LICENSE' 2024-05-22T21:48:23,592 writing manifest file '/tmp/pip-pip-egg-info-edr3wkfy/meeko.egg-info/SOURCES.txt' 2024-05-22T21:48:23,711 Preparing metadata (setup.py): finished with status 'done' 2024-05-22T21:48:23,716 Source in /tmp/pip-wheel-31blxqax/meeko_f4081b9fdc4245e992cde42d1db284d2 has version 0.5.1, which satisfies requirement meeko==0.5.1 from https://files.pythonhosted.org/packages/0f/cb/e51f5d788b046de6ddec15df59b455aef7c13914c5d2d5e519275ccf18a3/meeko-0.5.1.tar.gz 2024-05-22T21:48:23,717 Removed meeko==0.5.1 from https://files.pythonhosted.org/packages/0f/cb/e51f5d788b046de6ddec15df59b455aef7c13914c5d2d5e519275ccf18a3/meeko-0.5.1.tar.gz from build tracker '/tmp/pip-build-tracker-of83roey' 2024-05-22T21:48:23,725 Created temporary directory: /tmp/pip-unpack-ngwjciyx 2024-05-22T21:48:23,726 Created temporary directory: /tmp/pip-unpack-b4pzu2iz 2024-05-22T21:48:23,732 Building wheels for collected packages: meeko 2024-05-22T21:48:23,736 Created temporary directory: /tmp/pip-wheel-2_kqdiuw 2024-05-22T21:48:23,736 Building wheel for meeko (setup.py): started 2024-05-22T21:48:23,737 Destination directory: /tmp/pip-wheel-2_kqdiuw 2024-05-22T21:48:23,738 Running command python setup.py bdist_wheel 2024-05-22T21:48:24,835 running bdist_wheel 2024-05-22T21:48:24,933 running build 2024-05-22T21:48:24,934 running build_py 2024-05-22T21:48:24,962 creating build 2024-05-22T21:48:24,962 creating build/lib 2024-05-22T21:48:24,963 creating build/lib/meeko 2024-05-22T21:48:24,965 copying meeko/macrocycle.py -> build/lib/meeko 2024-05-22T21:48:24,967 copying meeko/covalentbuilder.py -> build/lib/meeko 2024-05-22T21:48:24,970 copying meeko/molecule_pdbqt.py -> build/lib/meeko 2024-05-22T21:48:24,972 copying meeko/preparation.py -> build/lib/meeko 2024-05-22T21:48:24,975 copying meeko/gridbox.py -> build/lib/meeko 2024-05-22T21:48:24,977 copying meeko/writer.py -> build/lib/meeko 2024-05-22T21:48:24,980 copying meeko/rdkit_mol_create.py -> build/lib/meeko 2024-05-22T21:48:24,982 copying meeko/atomtyper.py -> build/lib/meeko 2024-05-22T21:48:24,985 copying meeko/bondtyper.py -> build/lib/meeko 2024-05-22T21:48:24,987 copying meeko/hydrate.py -> build/lib/meeko 2024-05-22T21:48:24,989 copying meeko/flexibility.py -> build/lib/meeko 2024-05-22T21:48:24,991 copying meeko/__init__.py -> build/lib/meeko 2024-05-22T21:48:24,993 copying meeko/receptor_pdbqt.py -> build/lib/meeko 2024-05-22T21:48:24,995 copying meeko/molsetup.py -> build/lib/meeko 2024-05-22T21:48:24,998 copying meeko/reactive.py -> build/lib/meeko 2024-05-22T21:48:25,001 creating build/lib/meeko/analysis 2024-05-22T21:48:25,002 copying meeko/analysis/fingerprint_interactions.py -> build/lib/meeko/analysis 2024-05-22T21:48:25,004 copying meeko/analysis/__init__.py -> build/lib/meeko/analysis 2024-05-22T21:48:25,006 copying meeko/analysis/interactions.py -> build/lib/meeko/analysis 2024-05-22T21:48:25,009 creating build/lib/meeko/utils 2024-05-22T21:48:25,010 copying meeko/utils/utils.py -> build/lib/meeko/utils 2024-05-22T21:48:25,012 copying meeko/utils/van_der_waals_radius_table.py -> build/lib/meeko/utils 2024-05-22T21:48:25,014 copying meeko/utils/pdbutils.py -> build/lib/meeko/utils 2024-05-22T21:48:25,016 copying meeko/utils/autodock4_atom_types_elements.py -> build/lib/meeko/utils 2024-05-22T21:48:25,018 copying meeko/utils/covalent_radius_table.py -> build/lib/meeko/utils 2024-05-22T21:48:25,020 copying meeko/utils/geomutils.py -> build/lib/meeko/utils 2024-05-22T21:48:25,022 copying meeko/utils/__init__.py -> build/lib/meeko/utils 2024-05-22T21:48:25,024 copying meeko/utils/rdkitutils.py -> build/lib/meeko/utils 2024-05-22T21:48:25,026 copying meeko/utils/obutils.py -> build/lib/meeko/utils 2024-05-22T21:48:25,029 creating build/lib/meeko/cli 2024-05-22T21:48:25,030 copying meeko/cli/mk_export.py -> build/lib/meeko/cli 2024-05-22T21:48:25,032 copying meeko/cli/mk_prepare_receptor.py -> build/lib/meeko/cli 2024-05-22T21:48:25,035 copying meeko/cli/mk_prepare_ligand.py -> build/lib/meeko/cli 2024-05-22T21:48:25,038 copying meeko/cli/__init__.py -> build/lib/meeko/cli 2024-05-22T21:48:25,039 running egg_info 2024-05-22T21:48:25,100 writing meeko.egg-info/PKG-INFO 2024-05-22T21:48:25,105 writing dependency_links to meeko.egg-info/dependency_links.txt 2024-05-22T21:48:25,107 writing entry points to meeko.egg-info/entry_points.txt 2024-05-22T21:48:25,108 writing requirements to meeko.egg-info/requires.txt 2024-05-22T21:48:25,110 writing top-level names to meeko.egg-info/top_level.txt 2024-05-22T21:48:25,145 reading manifest file 'meeko.egg-info/SOURCES.txt' 2024-05-22T21:48:25,150 reading manifest template 'MANIFEST.in' 2024-05-22T21:48:25,152 warning: no files found matching 'example/*' 2024-05-22T21:48:25,154 adding license file 'LICENSE' 2024-05-22T21:48:25,157 writing manifest file 'meeko.egg-info/SOURCES.txt' 2024-05-22T21:48:25,160 /usr/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'meeko.data' is absent from the `packages` configuration. 2024-05-22T21:48:25,161 !! 2024-05-22T21:48:25,162 ******************************************************************************** 2024-05-22T21:48:25,163 ############################ 2024-05-22T21:48:25,163 # Package would be ignored # 2024-05-22T21:48:25,164 ############################ 2024-05-22T21:48:25,165 Python recognizes 'meeko.data' as an importable package[^1], 2024-05-22T21:48:25,165 but it is absent from setuptools' `packages` configuration. 2024-05-22T21:48:25,167 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-22T21:48:25,167 package, please make sure that 'meeko.data' is explicitly added 2024-05-22T21:48:25,168 to the `packages` configuration field. 2024-05-22T21:48:25,170 Alternatively, you can also rely on setuptools' discovery methods 2024-05-22T21:48:25,171 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-22T21:48:25,172 instead of `find_packages(...)`/`find:`). 2024-05-22T21:48:25,176 You can read more about "package discovery" on setuptools documentation page: 2024-05-22T21:48:25,178 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-22T21:48:25,180 If you don't want 'meeko.data' to be distributed and are 2024-05-22T21:48:25,181 already explicitly excluding 'meeko.data' via 2024-05-22T21:48:25,182 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-22T21:48:25,183 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-22T21:48:25,184 combination with a more fine grained `package-data` configuration. 2024-05-22T21:48:25,185 You can read more about "package data files" on setuptools documentation page: 2024-05-22T21:48:25,187 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-22T21:48:25,190 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-22T21:48:25,191 even if it does not contain any `.py` files. 2024-05-22T21:48:25,192 On the other hand, currently there is no concept of package data 2024-05-22T21:48:25,192 directory, all directories are treated like packages. 2024-05-22T21:48:25,193 ******************************************************************************** 2024-05-22T21:48:25,194 !! 2024-05-22T21:48:25,194 check.warn(importable) 2024-05-22T21:48:25,195 /usr/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'meeko.tmp' is absent from the `packages` configuration. 2024-05-22T21:48:25,195 !! 2024-05-22T21:48:25,197 ******************************************************************************** 2024-05-22T21:48:25,197 ############################ 2024-05-22T21:48:25,198 # Package would be ignored # 2024-05-22T21:48:25,198 ############################ 2024-05-22T21:48:25,199 Python recognizes 'meeko.tmp' as an importable package[^1], 2024-05-22T21:48:25,199 but it is absent from setuptools' `packages` configuration. 2024-05-22T21:48:25,201 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-22T21:48:25,201 package, please make sure that 'meeko.tmp' is explicitly added 2024-05-22T21:48:25,202 to the `packages` configuration field. 2024-05-22T21:48:25,203 Alternatively, you can also rely on setuptools' discovery methods 2024-05-22T21:48:25,205 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-22T21:48:25,206 instead of `find_packages(...)`/`find:`). 2024-05-22T21:48:25,208 You can read more about "package discovery" on setuptools documentation page: 2024-05-22T21:48:25,210 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-22T21:48:25,213 If you don't want 'meeko.tmp' to be distributed and are 2024-05-22T21:48:25,214 already explicitly excluding 'meeko.tmp' via 2024-05-22T21:48:25,216 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-22T21:48:25,217 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-22T21:48:25,219 combination with a more fine grained `package-data` configuration. 2024-05-22T21:48:25,222 You can read more about "package data files" on setuptools documentation page: 2024-05-22T21:48:25,223 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-22T21:48:25,225 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-22T21:48:25,226 even if it does not contain any `.py` files. 2024-05-22T21:48:25,226 On the other hand, currently there is no concept of package data 2024-05-22T21:48:25,227 directory, all directories are treated like packages. 2024-05-22T21:48:25,228 ******************************************************************************** 2024-05-22T21:48:25,229 !! 2024-05-22T21:48:25,230 check.warn(importable) 2024-05-22T21:48:25,230 creating build/lib/meeko/data 2024-05-22T21:48:25,231 copying meeko/data/atomtypes.txt -> build/lib/meeko/data 2024-05-22T21:48:25,231 copying meeko/data/flexres_templates.json -> build/lib/meeko/data 2024-05-22T21:48:25,232 copying meeko/data/pi_non_aromatic.txt -> build/lib/meeko/data 2024-05-22T21:48:25,232 copying meeko/data/residue_params.json -> build/lib/meeko/data 2024-05-22T21:48:25,233 copying meeko/data/waterfield.txt -> build/lib/meeko/data 2024-05-22T21:48:25,233 creating build/lib/meeko/tmp 2024-05-22T21:48:25,234 copying meeko/tmp/compute_water_map.py -> build/lib/meeko/tmp 2024-05-22T21:48:25,234 copying meeko/tmp/water_builder.py -> build/lib/meeko/tmp 2024-05-22T21:48:25,235 copying meeko/tmp/water_map_builder.py -> build/lib/meeko/tmp 2024-05-22T21:48:25,253 /usr/local/lib/python3.11/dist-packages/setuptools/_distutils/cmd.py:66: SetuptoolsDeprecationWarning: setup.py install is deprecated. 2024-05-22T21:48:25,253 !! 2024-05-22T21:48:25,254 ******************************************************************************** 2024-05-22T21:48:25,255 Please avoid running ``setup.py`` directly. 2024-05-22T21:48:25,255 Instead, use pypa/build, pypa/installer or other 2024-05-22T21:48:25,256 standards-based tools. 2024-05-22T21:48:25,257 See https://blog.ganssle.io/articles/2021/10/setup-py-deprecated.html for details. 2024-05-22T21:48:25,257 ******************************************************************************** 2024-05-22T21:48:25,258 !! 2024-05-22T21:48:25,259 self.initialize_options() 2024-05-22T21:48:25,279 installing to build/bdist.linux-armv7l/wheel 2024-05-22T21:48:25,280 running install 2024-05-22T21:48:25,305 running install_lib 2024-05-22T21:48:25,330 creating build/bdist.linux-armv7l 2024-05-22T21:48:25,331 creating build/bdist.linux-armv7l/wheel 2024-05-22T21:48:25,333 creating build/bdist.linux-armv7l/wheel/meeko 2024-05-22T21:48:25,334 copying build/lib/meeko/macrocycle.py -> build/bdist.linux-armv7l/wheel/meeko 2024-05-22T21:48:25,338 creating build/bdist.linux-armv7l/wheel/meeko/data 2024-05-22T21:48:25,338 copying build/lib/meeko/data/residue_params.json -> build/bdist.linux-armv7l/wheel/meeko/data 2024-05-22T21:48:25,345 copying build/lib/meeko/data/atomtypes.txt -> build/bdist.linux-armv7l/wheel/meeko/data 2024-05-22T21:48:25,347 copying build/lib/meeko/data/waterfield.txt -> build/bdist.linux-armv7l/wheel/meeko/data 2024-05-22T21:48:25,349 copying build/lib/meeko/data/pi_non_aromatic.txt -> build/bdist.linux-armv7l/wheel/meeko/data 2024-05-22T21:48:25,352 copying build/lib/meeko/data/flexres_templates.json -> build/bdist.linux-armv7l/wheel/meeko/data 2024-05-22T21:48:25,354 copying build/lib/meeko/covalentbuilder.py -> build/bdist.linux-armv7l/wheel/meeko 2024-05-22T21:48:25,357 copying build/lib/meeko/molecule_pdbqt.py -> build/bdist.linux-armv7l/wheel/meeko 2024-05-22T21:48:25,361 creating build/bdist.linux-armv7l/wheel/meeko/analysis 2024-05-22T21:48:25,362 copying build/lib/meeko/analysis/fingerprint_interactions.py -> build/bdist.linux-armv7l/wheel/meeko/analysis 2024-05-22T21:48:25,364 copying build/lib/meeko/analysis/__init__.py -> build/bdist.linux-armv7l/wheel/meeko/analysis 2024-05-22T21:48:25,366 copying build/lib/meeko/analysis/interactions.py -> build/bdist.linux-armv7l/wheel/meeko/analysis 2024-05-22T21:48:25,369 creating build/bdist.linux-armv7l/wheel/meeko/utils 2024-05-22T21:48:25,370 copying build/lib/meeko/utils/utils.py -> build/bdist.linux-armv7l/wheel/meeko/utils 2024-05-22T21:48:25,373 copying build/lib/meeko/utils/van_der_waals_radius_table.py -> build/bdist.linux-armv7l/wheel/meeko/utils 2024-05-22T21:48:25,375 copying build/lib/meeko/utils/pdbutils.py -> build/bdist.linux-armv7l/wheel/meeko/utils 2024-05-22T21:48:25,377 copying build/lib/meeko/utils/autodock4_atom_types_elements.py -> build/bdist.linux-armv7l/wheel/meeko/utils 2024-05-22T21:48:25,379 copying build/lib/meeko/utils/covalent_radius_table.py -> build/bdist.linux-armv7l/wheel/meeko/utils 2024-05-22T21:48:25,381 copying build/lib/meeko/utils/geomutils.py -> build/bdist.linux-armv7l/wheel/meeko/utils 2024-05-22T21:48:25,383 copying build/lib/meeko/utils/__init__.py -> build/bdist.linux-armv7l/wheel/meeko/utils 2024-05-22T21:48:25,385 copying build/lib/meeko/utils/rdkitutils.py -> build/bdist.linux-armv7l/wheel/meeko/utils 2024-05-22T21:48:25,387 copying build/lib/meeko/utils/obutils.py -> build/bdist.linux-armv7l/wheel/meeko/utils 2024-05-22T21:48:25,389 copying build/lib/meeko/preparation.py -> build/bdist.linux-armv7l/wheel/meeko 2024-05-22T21:48:25,391 copying build/lib/meeko/gridbox.py -> build/bdist.linux-armv7l/wheel/meeko 2024-05-22T21:48:25,394 copying build/lib/meeko/writer.py -> build/bdist.linux-armv7l/wheel/meeko 2024-05-22T21:48:25,397 creating build/bdist.linux-armv7l/wheel/meeko/tmp 2024-05-22T21:48:25,397 copying build/lib/meeko/tmp/water_map_builder.py -> build/bdist.linux-armv7l/wheel/meeko/tmp 2024-05-22T21:48:25,400 copying build/lib/meeko/tmp/water_builder.py -> build/bdist.linux-armv7l/wheel/meeko/tmp 2024-05-22T21:48:25,403 copying build/lib/meeko/tmp/compute_water_map.py -> build/bdist.linux-armv7l/wheel/meeko/tmp 2024-05-22T21:48:25,406 copying build/lib/meeko/rdkit_mol_create.py -> build/bdist.linux-armv7l/wheel/meeko 2024-05-22T21:48:25,408 creating build/bdist.linux-armv7l/wheel/meeko/cli 2024-05-22T21:48:25,409 copying build/lib/meeko/cli/mk_export.py -> build/bdist.linux-armv7l/wheel/meeko/cli 2024-05-22T21:48:25,412 copying build/lib/meeko/cli/mk_prepare_receptor.py -> build/bdist.linux-armv7l/wheel/meeko/cli 2024-05-22T21:48:25,414 copying build/lib/meeko/cli/mk_prepare_ligand.py -> build/bdist.linux-armv7l/wheel/meeko/cli 2024-05-22T21:48:25,417 copying build/lib/meeko/cli/__init__.py -> build/bdist.linux-armv7l/wheel/meeko/cli 2024-05-22T21:48:25,419 copying build/lib/meeko/atomtyper.py -> build/bdist.linux-armv7l/wheel/meeko 2024-05-22T21:48:25,421 copying build/lib/meeko/bondtyper.py -> build/bdist.linux-armv7l/wheel/meeko 2024-05-22T21:48:25,423 copying build/lib/meeko/hydrate.py -> build/bdist.linux-armv7l/wheel/meeko 2024-05-22T21:48:25,425 copying build/lib/meeko/flexibility.py -> build/bdist.linux-armv7l/wheel/meeko 2024-05-22T21:48:25,428 copying build/lib/meeko/__init__.py -> build/bdist.linux-armv7l/wheel/meeko 2024-05-22T21:48:25,429 copying build/lib/meeko/receptor_pdbqt.py -> build/bdist.linux-armv7l/wheel/meeko 2024-05-22T21:48:25,432 copying build/lib/meeko/molsetup.py -> build/bdist.linux-armv7l/wheel/meeko 2024-05-22T21:48:25,435 copying build/lib/meeko/reactive.py -> build/bdist.linux-armv7l/wheel/meeko 2024-05-22T21:48:25,437 running install_egg_info 2024-05-22T21:48:25,470 Copying meeko.egg-info to build/bdist.linux-armv7l/wheel/meeko-0.5.1-py3.11.egg-info 2024-05-22T21:48:25,483 running install_scripts 2024-05-22T21:48:25,500 creating build/bdist.linux-armv7l/wheel/meeko-0.5.1.dist-info/WHEEL 2024-05-22T21:48:25,503 creating '/tmp/pip-wheel-2_kqdiuw/meeko-0.5.1-py3-none-any.whl' and adding 'build/bdist.linux-armv7l/wheel' to it 2024-05-22T21:48:25,506 adding 'meeko/__init__.py' 2024-05-22T21:48:25,508 adding 'meeko/atomtyper.py' 2024-05-22T21:48:25,510 adding 'meeko/bondtyper.py' 2024-05-22T21:48:25,512 adding 'meeko/covalentbuilder.py' 2024-05-22T21:48:25,515 adding 'meeko/flexibility.py' 2024-05-22T21:48:25,516 adding 'meeko/gridbox.py' 2024-05-22T21:48:25,518 adding 'meeko/hydrate.py' 2024-05-22T21:48:25,520 adding 'meeko/macrocycle.py' 2024-05-22T21:48:25,524 adding 'meeko/molecule_pdbqt.py' 2024-05-22T21:48:25,528 adding 'meeko/molsetup.py' 2024-05-22T21:48:25,530 adding 'meeko/preparation.py' 2024-05-22T21:48:25,532 adding 'meeko/rdkit_mol_create.py' 2024-05-22T21:48:25,534 adding 'meeko/reactive.py' 2024-05-22T21:48:25,537 adding 'meeko/receptor_pdbqt.py' 2024-05-22T21:48:25,539 adding 'meeko/writer.py' 2024-05-22T21:48:25,541 adding 'meeko/analysis/__init__.py' 2024-05-22T21:48:25,542 adding 'meeko/analysis/fingerprint_interactions.py' 2024-05-22T21:48:25,544 adding 'meeko/analysis/interactions.py' 2024-05-22T21:48:25,545 adding 'meeko/cli/__init__.py' 2024-05-22T21:48:25,547 adding 'meeko/cli/mk_export.py' 2024-05-22T21:48:25,549 adding 'meeko/cli/mk_prepare_ligand.py' 2024-05-22T21:48:25,552 adding 'meeko/cli/mk_prepare_receptor.py' 2024-05-22T21:48:25,554 adding 'meeko/data/atomtypes.txt' 2024-05-22T21:48:25,555 adding 'meeko/data/flexres_templates.json' 2024-05-22T21:48:25,557 adding 'meeko/data/pi_non_aromatic.txt' 2024-05-22T21:48:25,567 adding 'meeko/data/residue_params.json' 2024-05-22T21:48:25,570 adding 'meeko/data/waterfield.txt' 2024-05-22T21:48:25,572 adding 'meeko/tmp/compute_water_map.py' 2024-05-22T21:48:25,575 adding 'meeko/tmp/water_builder.py' 2024-05-22T21:48:25,577 adding 'meeko/tmp/water_map_builder.py' 2024-05-22T21:48:25,579 adding 'meeko/utils/__init__.py' 2024-05-22T21:48:25,581 adding 'meeko/utils/autodock4_atom_types_elements.py' 2024-05-22T21:48:25,583 adding 'meeko/utils/covalent_radius_table.py' 2024-05-22T21:48:25,585 adding 'meeko/utils/geomutils.py' 2024-05-22T21:48:25,587 adding 'meeko/utils/obutils.py' 2024-05-22T21:48:25,588 adding 'meeko/utils/pdbutils.py' 2024-05-22T21:48:25,589 adding 'meeko/utils/rdkitutils.py' 2024-05-22T21:48:25,592 adding 'meeko/utils/utils.py' 2024-05-22T21:48:25,593 adding 'meeko/utils/van_der_waals_radius_table.py' 2024-05-22T21:48:25,598 adding 'meeko-0.5.1.dist-info/LICENSE' 2024-05-22T21:48:25,600 adding 'meeko-0.5.1.dist-info/METADATA' 2024-05-22T21:48:25,602 adding 'meeko-0.5.1.dist-info/WHEEL' 2024-05-22T21:48:25,603 adding 'meeko-0.5.1.dist-info/entry_points.txt' 2024-05-22T21:48:25,604 adding 'meeko-0.5.1.dist-info/top_level.txt' 2024-05-22T21:48:25,605 adding 'meeko-0.5.1.dist-info/RECORD' 2024-05-22T21:48:25,610 removing build/bdist.linux-armv7l/wheel 2024-05-22T21:48:25,749 Building wheel for meeko (setup.py): finished with status 'done' 2024-05-22T21:48:25,753 Created wheel for meeko: filename=meeko-0.5.1-py3-none-any.whl size=129961 sha256=e307d2724fcb8af5b3fa3876d01c4499449da199af949157757b1f1a22d34b06 2024-05-22T21:48:25,754 Stored in directory: /tmp/pip-ephem-wheel-cache-mucv61ii/wheels/e5/87/28/51019dfa18a7fad3160d241a347d86382a0434f1f55bb52696 2024-05-22T21:48:25,769 Successfully built meeko 2024-05-22T21:48:25,777 Removed build tracker: '/tmp/pip-build-tracker-of83roey'