2021-12-19T03:29:49,254 Created temporary directory: /tmp/pip-ephem-wheel-cache-m4y556q4 2021-12-19T03:29:49,263 Created temporary directory: /tmp/pip-req-tracker-edom31a6 2021-12-19T03:29:49,263 Initialized build tracking at /tmp/pip-req-tracker-edom31a6 2021-12-19T03:29:49,264 Created build tracker: /tmp/pip-req-tracker-edom31a6 2021-12-19T03:29:49,264 Entered build tracker: /tmp/pip-req-tracker-edom31a6 2021-12-19T03:29:49,266 Created temporary directory: /tmp/pip-wheel-_h_t3l36 2021-12-19T03:29:49,326 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2021-12-19T03:29:49,330 2 location(s) to search for versions of peleffy: 2021-12-19T03:29:49,330 * https://pypi.org/simple/peleffy/ 2021-12-19T03:29:49,330 * https://www.piwheels.org/simple/peleffy/ 2021-12-19T03:29:49,330 Fetching project page and analyzing links: https://pypi.org/simple/peleffy/ 2021-12-19T03:29:49,333 Getting page https://pypi.org/simple/peleffy/ 2021-12-19T03:29:49,337 Found index url https://pypi.org/simple 2021-12-19T03:29:49,597 Skipping link: No binaries permitted for peleffy: https://files.pythonhosted.org/packages/57/27/fe4ea3635dbae7397b548ec911d3541e62676b389ce0e71d985aaf10e04a/peleffy-1.0.0-py3-none-any.whl#sha256=2ab64b6bbe61be4685b18c5d3f56c8e3f421b7bac1ac200647052a84d6c16aad (from https://pypi.org/simple/peleffy/) 2021-12-19T03:29:49,598 Found link https://files.pythonhosted.org/packages/21/3e/8ab417b81c0fa43dc49e60e2512d2dd844f46dabce6689baa7963b8fbc15/peleffy-1.0.0.tar.gz#sha256=fe59b07a6dc9bf53afba0582885a02388928ab5f286bdf5d341d983ad762c709 (from https://pypi.org/simple/peleffy/), version: 1.0.0 2021-12-19T03:29:49,599 Skipping link: No binaries permitted for peleffy: https://files.pythonhosted.org/packages/62/da/beeca76271cb160a638488343a1c35382476f1e0ed1cb04e6ab2dcfa9140/peleffy-1.1.0-py3-none-any.whl#sha256=a3df3f04ad8aa2a3186a66e5b6e43de5d1defdfed840dcb07721802a24af6990 (from https://pypi.org/simple/peleffy/) 2021-12-19T03:29:49,600 Found link https://files.pythonhosted.org/packages/b4/41/111d2ac6171d8948df8288d96295c8f2e5d15295270d7b01c5e36a4b0d91/peleffy-1.1.0.tar.gz#sha256=96789197c26e716073ba6cfb499efa274bc397376db18e9e819338c5b7330bf6 (from https://pypi.org/simple/peleffy/), version: 1.1.0 2021-12-19T03:29:49,600 Skipping link: No binaries permitted for peleffy: https://files.pythonhosted.org/packages/aa/67/51cbe4caa50d8cc3543c10801a9890e7968b4762d0277c438e7d6773a9a5/peleffy-1.2.0-py3-none-any.whl#sha256=e878b857b29bde2ff999215982041bd08680346fffc267b78cc62af8f2a8cde4 (from https://pypi.org/simple/peleffy/) 2021-12-19T03:29:49,601 Found link https://files.pythonhosted.org/packages/77/71/cd1471fb09edfcf870fe4905b27e3fa27449c31225c45271074fa45da585/peleffy-1.2.0.tar.gz#sha256=d29d4b3ef0c74f831696fffae2353b7047073a4e2a20dbb0c0bd9d649b5f9da0 (from https://pypi.org/simple/peleffy/), version: 1.2.0 2021-12-19T03:29:49,602 Skipping link: No binaries permitted for peleffy: https://files.pythonhosted.org/packages/26/bf/2728b0b86b879cf87de97326f6675a6c5b5d71ae571f5612e3e1f75694ff/peleffy-1.2.1-py3-none-any.whl#sha256=04d6f2dc8e0ca11fd5e70b0e38be6712740504f6fa22f5079aa3c1a2508db4c0 (from https://pypi.org/simple/peleffy/) 2021-12-19T03:29:49,603 Found link https://files.pythonhosted.org/packages/97/a8/e35adddd101d6895288960cfabfb39fa1b29099a2829332908e51c832c16/peleffy-1.2.1.tar.gz#sha256=0ac701cd7aee59bd1d655fa09eb4b6075db7e57497e484eabe883f4be39c2a24 (from https://pypi.org/simple/peleffy/), version: 1.2.1 2021-12-19T03:29:49,604 Skipping link: No binaries permitted for peleffy: https://files.pythonhosted.org/packages/2c/05/491552e7ffa6f8d88536cd1e3ceabe1fc1b181178216a1da5b9dc77df4ee/peleffy-1.3.0-py3-none-any.whl#sha256=7d7a810376b98b03bf32028fc48adfb2d86f05ae26e88d614c9655718e218ab5 (from https://pypi.org/simple/peleffy/) 2021-12-19T03:29:49,604 Found link https://files.pythonhosted.org/packages/64/2b/8008f4e0c299218f926f89d6d4f67680103e72231ed1471be1734d716785/peleffy-1.3.0.tar.gz#sha256=cdd50acc4a7fe22555bb14357f20a21c85bd0e38b10bd65818d9fb185ddc08af (from https://pypi.org/simple/peleffy/), version: 1.3.0 2021-12-19T03:29:49,605 Skipping link: No binaries permitted for peleffy: https://files.pythonhosted.org/packages/b5/71/f1db0dd925963a93165f0c8f0b3472cb2a431ec16458ab68051815695b63/peleffy-1.3.1-py3-none-any.whl#sha256=bad886f07bcb8f522e920bfd87d4716628d48951f8580f9a8672e5a5377f5796 (from https://pypi.org/simple/peleffy/) 2021-12-19T03:29:49,606 Found link https://files.pythonhosted.org/packages/5e/78/58c8cae1e1909489e68560275e9df277523bc3900542f6be83a38f3f7bbd/peleffy-1.3.1.tar.gz#sha256=d7d21c9fd1bd302462e88eb7f015975ad0e282bfab2e00f205190b3ee840781f (from https://pypi.org/simple/peleffy/), version: 1.3.1 2021-12-19T03:29:49,607 Skipping link: No binaries permitted for peleffy: https://files.pythonhosted.org/packages/87/89/6952471b60b6086b10023459205daaf6050092d51e5631208549cc45a50b/peleffy-1.3.2-py3-none-any.whl#sha256=b024570ac45d792ccc610b8fba1bc3c68fb73d8890b24361df11072abaf00ed5 (from https://pypi.org/simple/peleffy/) 2021-12-19T03:29:49,608 Found link https://files.pythonhosted.org/packages/9b/55/7caefb115eae92faf59156fe64ae426ee1dc63d0cf34e28329f348343ce0/peleffy-1.3.2.tar.gz#sha256=4903750e6d98491039a145a53c10dc8061b837c2f514580545e2c5a00edca90b (from https://pypi.org/simple/peleffy/), version: 1.3.2 2021-12-19T03:29:49,609 Skipping link: No binaries permitted for peleffy: https://files.pythonhosted.org/packages/8b/03/46f6d954892d46c641355d89b8786dc13ed9bc7f56480538fc86f13b3338/peleffy-1.3.3-py3-none-any.whl#sha256=635aa7b84bdbc7d6fb517586bea1dd2017a4de0f265a2c6852a782b1e580fb5a (from https://pypi.org/simple/peleffy/) 2021-12-19T03:29:49,609 Found link https://files.pythonhosted.org/packages/8a/f7/004635dfc277e05a90427a564820dc515a75826175fd148d377f3316d67c/peleffy-1.3.3.tar.gz#sha256=e4237cac697f3b09a4547274095e93bc44d5806daa7149071350787db8f418ae (from https://pypi.org/simple/peleffy/), version: 1.3.3 2021-12-19T03:29:49,610 Skipping link: No binaries permitted for peleffy: https://files.pythonhosted.org/packages/44/9a/142e600e2e0c5b64c6440c959978510aa101917b7199ab32081105163738/peleffy-1.3.4-py3-none-any.whl#sha256=4e2f9dcf3f4ebcb9638fc98d270ba60b26fae35087e4484c0bcdda06f1d40bd3 (from https://pypi.org/simple/peleffy/) 2021-12-19T03:29:49,611 Found link https://files.pythonhosted.org/packages/52/d5/f5588550aa1091c2b1530ce177c29924a6e958a6f70427d51f8f9f992123/peleffy-1.3.4.tar.gz#sha256=9d7312f8c4a76eeed03cad72209f7c4d7418784c5dcfe283d32ecc2f4f1ce4ce (from https://pypi.org/simple/peleffy/), version: 1.3.4 2021-12-19T03:29:49,612 Skipping link: No binaries permitted for peleffy: https://files.pythonhosted.org/packages/f1/32/cf49d3b3e43de05458f3471def0e26e22128e0bd7a6f4c9caa6fd5cdbbf0/peleffy-1.4.0-py3-none-any.whl#sha256=ddb489b57fc5e3c61384d9ac49dd90c9ba386b94df38d60f95256e4fcf21a7be (from https://pypi.org/simple/peleffy/) 2021-12-19T03:29:49,612 Found link https://files.pythonhosted.org/packages/23/e1/73f8fbc4c275abab8f19452d6eaad40918b4f970c8c0a7468772f137d267/peleffy-1.4.0.tar.gz#sha256=93f2c25380d5d9a2c47ba1d54e934ad520fdc5cb66dd949177b13cc22e99b1f8 (from https://pypi.org/simple/peleffy/), version: 1.4.0 2021-12-19T03:29:49,613 Skipping link: No binaries permitted for peleffy: https://files.pythonhosted.org/packages/ba/df/ce97e6e37c943d77a389fe6c2b4d418ec414a8e20c27e59ee04fd79e6b8b/peleffy-1.4.1-py3-none-any.whl#sha256=b52497a007b3dd5e69804c7ddbd5f411c3ee4f6834f75309897c1c6b2287b316 (from https://pypi.org/simple/peleffy/) 2021-12-19T03:29:49,614 Found link https://files.pythonhosted.org/packages/0d/cc/17c8fe292a8685a6ba9a288631a18a81caf383642c13aa4d141cd87898ec/peleffy-1.4.1.tar.gz#sha256=557bddaa1a6bf13175095f8fce193b35260870535e3e0978a77700f0e11f18cc (from https://pypi.org/simple/peleffy/), version: 1.4.1 2021-12-19T03:29:49,615 Fetching project page and analyzing links: https://www.piwheels.org/simple/peleffy/ 2021-12-19T03:29:49,616 Getting page https://www.piwheels.org/simple/peleffy/ 2021-12-19T03:29:49,618 Found index url https://www.piwheels.org/simple 2021-12-19T03:29:49,892 Skipping link: No binaries permitted for peleffy: https://www.piwheels.org/simple/peleffy/peleffy-1.0.0-py3-none-any.whl#sha256=2ab64b6bbe61be4685b18c5d3f56c8e3f421b7bac1ac200647052a84d6c16aad (from https://www.piwheels.org/simple/peleffy/) 2021-12-19T03:29:49,893 Skipping link: No binaries permitted for peleffy: https://www.piwheels.org/simple/peleffy/peleffy-1.1.0-py3-none-any.whl#sha256=a3df3f04ad8aa2a3186a66e5b6e43de5d1defdfed840dcb07721802a24af6990 (from https://www.piwheels.org/simple/peleffy/) 2021-12-19T03:29:49,893 Skipping link: No binaries permitted for peleffy: https://www.piwheels.org/simple/peleffy/peleffy-1.2.0-py3-none-any.whl#sha256=e878b857b29bde2ff999215982041bd08680346fffc267b78cc62af8f2a8cde4 (from https://www.piwheels.org/simple/peleffy/) 2021-12-19T03:29:49,894 Skipping link: No binaries permitted for peleffy: https://www.piwheels.org/simple/peleffy/peleffy-1.2.1-py3-none-any.whl#sha256=04d6f2dc8e0ca11fd5e70b0e38be6712740504f6fa22f5079aa3c1a2508db4c0 (from https://www.piwheels.org/simple/peleffy/) 2021-12-19T03:29:49,894 Skipping link: No binaries permitted for peleffy: https://www.piwheels.org/simple/peleffy/peleffy-1.3.0-py3-none-any.whl#sha256=7d7a810376b98b03bf32028fc48adfb2d86f05ae26e88d614c9655718e218ab5 (from https://www.piwheels.org/simple/peleffy/) 2021-12-19T03:29:49,895 Skipping link: No binaries permitted for peleffy: https://www.piwheels.org/simple/peleffy/peleffy-1.3.1-py3-none-any.whl#sha256=bad886f07bcb8f522e920bfd87d4716628d48951f8580f9a8672e5a5377f5796 (from https://www.piwheels.org/simple/peleffy/) 2021-12-19T03:29:49,895 Skipping link: No binaries permitted for peleffy: https://www.piwheels.org/simple/peleffy/peleffy-1.3.2-py3-none-any.whl#sha256=b024570ac45d792ccc610b8fba1bc3c68fb73d8890b24361df11072abaf00ed5 (from https://www.piwheels.org/simple/peleffy/) 2021-12-19T03:29:49,896 Skipping link: No binaries permitted for peleffy: https://www.piwheels.org/simple/peleffy/peleffy-1.3.3-py3-none-any.whl#sha256=635aa7b84bdbc7d6fb517586bea1dd2017a4de0f265a2c6852a782b1e580fb5a (from https://www.piwheels.org/simple/peleffy/) 2021-12-19T03:29:49,896 Skipping link: No binaries permitted for peleffy: https://www.piwheels.org/simple/peleffy/peleffy-1.3.4-py3-none-any.whl#sha256=fc84e6c0426bdb9531d957c0875044c2cbfa9c2dfe9e7305ebf4dc7f9de98726 (from https://www.piwheels.org/simple/peleffy/) 2021-12-19T03:29:49,897 Skipping link: No binaries permitted for peleffy: https://www.piwheels.org/simple/peleffy/peleffy-1.4.0-py3-none-any.whl#sha256=bd3f73ab6827bf9ffca67a4f1e37b4b7f6938dbcaff53f571bad4865d0dff579 (from https://www.piwheels.org/simple/peleffy/) 2021-12-19T03:29:49,932 Given no hashes to check 1 links for project 'peleffy': discarding no candidates 2021-12-19T03:29:49,964 Collecting peleffy==1.4.1 2021-12-19T03:29:49,968 Created temporary directory: /tmp/pip-unpack-02qlahs9 2021-12-19T03:29:50,208 Downloading peleffy-1.4.1.tar.gz (581 kB) 2021-12-19T03:29:51,670 Added peleffy==1.4.1 from https://files.pythonhosted.org/packages/0d/cc/17c8fe292a8685a6ba9a288631a18a81caf383642c13aa4d141cd87898ec/peleffy-1.4.1.tar.gz#sha256=557bddaa1a6bf13175095f8fce193b35260870535e3e0978a77700f0e11f18cc to build tracker '/tmp/pip-req-tracker-edom31a6' 2021-12-19T03:29:51,672 Running setup.py (path:/tmp/pip-wheel-_h_t3l36/peleffy_9f788edde565419aa00610a3ae3d1d3a/setup.py) egg_info for package peleffy 2021-12-19T03:29:51,674 Created temporary directory: /tmp/pip-pip-egg-info-oh5osj32 2021-12-19T03:29:51,674 Running command python setup.py egg_info 2021-12-19T03:29:54,272 running egg_info 2021-12-19T03:29:54,277 creating /tmp/pip-pip-egg-info-oh5osj32/peleffy.egg-info 2021-12-19T03:29:54,281 writing dependency_links to /tmp/pip-pip-egg-info-oh5osj32/peleffy.egg-info/dependency_links.txt 2021-12-19T03:29:54,283 writing top-level names to /tmp/pip-pip-egg-info-oh5osj32/peleffy.egg-info/top_level.txt 2021-12-19T03:29:54,287 writing /tmp/pip-pip-egg-info-oh5osj32/peleffy.egg-info/PKG-INFO 2021-12-19T03:29:54,293 writing manifest file '/tmp/pip-pip-egg-info-oh5osj32/peleffy.egg-info/SOURCES.txt' 2021-12-19T03:29:54,307 package init file 'peleffy/data/__init__.py' not found (or not a regular file) 2021-12-19T03:29:54,357 reading manifest file '/tmp/pip-pip-egg-info-oh5osj32/peleffy.egg-info/SOURCES.txt' 2021-12-19T03:29:54,360 reading manifest template 'MANIFEST.in' 2021-12-19T03:29:54,379 writing manifest file '/tmp/pip-pip-egg-info-oh5osj32/peleffy.egg-info/SOURCES.txt' 2021-12-19T03:29:54,516 Source in /tmp/pip-wheel-_h_t3l36/peleffy_9f788edde565419aa00610a3ae3d1d3a has version 1.4.1, which satisfies requirement peleffy==1.4.1 from https://files.pythonhosted.org/packages/0d/cc/17c8fe292a8685a6ba9a288631a18a81caf383642c13aa4d141cd87898ec/peleffy-1.4.1.tar.gz#sha256=557bddaa1a6bf13175095f8fce193b35260870535e3e0978a77700f0e11f18cc 2021-12-19T03:29:54,518 Removed peleffy==1.4.1 from https://files.pythonhosted.org/packages/0d/cc/17c8fe292a8685a6ba9a288631a18a81caf383642c13aa4d141cd87898ec/peleffy-1.4.1.tar.gz#sha256=557bddaa1a6bf13175095f8fce193b35260870535e3e0978a77700f0e11f18cc from build tracker '/tmp/pip-req-tracker-edom31a6' 2021-12-19T03:29:54,526 Created temporary directory: /tmp/pip-unpack-olktozf7 2021-12-19T03:29:54,527 Building wheels for collected packages: peleffy 2021-12-19T03:29:54,536 Created temporary directory: /tmp/pip-wheel-9fqunlr8 2021-12-19T03:29:54,537 Building wheel for peleffy (setup.py): started 2021-12-19T03:29:54,538 Destination directory: /tmp/pip-wheel-9fqunlr8 2021-12-19T03:29:54,539 Running command /usr/bin/python3 -u -c 'import sys, setuptools, tokenize; sys.argv[0] = '"'"'/tmp/pip-wheel-_h_t3l36/peleffy_9f788edde565419aa00610a3ae3d1d3a/setup.py'"'"'; __file__='"'"'/tmp/pip-wheel-_h_t3l36/peleffy_9f788edde565419aa00610a3ae3d1d3a/setup.py'"'"';f=getattr(tokenize, '"'"'open'"'"', open)(__file__);code=f.read().replace('"'"'\r\n'"'"', '"'"'\n'"'"');f.close();exec(compile(code, __file__, '"'"'exec'"'"'))' bdist_wheel -d /tmp/pip-wheel-9fqunlr8 2021-12-19T03:29:57,056 running bdist_wheel 2021-12-19T03:29:57,067 running build 2021-12-19T03:29:57,068 running build_py 2021-12-19T03:29:57,080 creating build 2021-12-19T03:29:57,081 creating build/lib 2021-12-19T03:29:57,083 creating build/lib/peleffy 2021-12-19T03:29:57,085 copying peleffy/main.py -> build/lib/peleffy 2021-12-19T03:29:57,091 copying peleffy/_version.py -> build/lib/peleffy 2021-12-19T03:29:57,094 copying peleffy/__init__.py -> build/lib/peleffy 2021-12-19T03:29:57,104 creating build/lib/peleffy/tests 2021-12-19T03:29:57,106 copying peleffy/tests/test_solvent.py -> build/lib/peleffy/tests 2021-12-19T03:29:57,113 copying peleffy/tests/utils.py -> build/lib/peleffy/tests 2021-12-19T03:29:57,120 copying peleffy/tests/test_topology.py -> build/lib/peleffy/tests 2021-12-19T03:29:57,126 copying peleffy/tests/test_mapper.py -> build/lib/peleffy/tests 2021-12-19T03:29:57,130 copying peleffy/tests/test_utils.py -> build/lib/peleffy/tests 2021-12-19T03:29:57,139 copying peleffy/tests/test_alchemistry.py -> build/lib/peleffy/tests 2021-12-19T03:29:57,161 copying peleffy/tests/test_integrity.py -> build/lib/peleffy/tests 2021-12-19T03:29:57,166 copying peleffy/tests/__init__.py -> build/lib/peleffy/tests 2021-12-19T03:29:57,170 copying peleffy/tests/test_molecule.py -> build/lib/peleffy/tests 2021-12-19T03:29:57,178 copying peleffy/tests/test_forcefields.py -> build/lib/peleffy/tests 2021-12-19T03:29:57,185 copying peleffy/tests/test_conformers.py -> build/lib/peleffy/tests 2021-12-19T03:29:57,190 copying peleffy/tests/test_rotamers.py -> build/lib/peleffy/tests 2021-12-19T03:29:57,198 copying peleffy/tests/test_main.py -> build/lib/peleffy/tests 2021-12-19T03:29:57,205 copying peleffy/tests/test_templates.py -> build/lib/peleffy/tests 2021-12-19T03:29:57,213 copying peleffy/tests/test_parameters.py -> build/lib/peleffy/tests 2021-12-19T03:29:57,224 copying peleffy/tests/test_toolkits.py -> build/lib/peleffy/tests 2021-12-19T03:29:57,230 package init file 'peleffy/data/__init__.py' not found (or not a regular file) 2021-12-19T03:29:57,234 creating build/lib/peleffy/template 2021-12-19T03:29:57,237 copying peleffy/template/impact.py -> build/lib/peleffy/template 2021-12-19T03:29:57,246 copying peleffy/template/__init__.py -> build/lib/peleffy/template 2021-12-19T03:29:57,253 creating build/lib/peleffy/solvent 2021-12-19T03:29:57,255 copying peleffy/solvent/__init__.py -> build/lib/peleffy/solvent 2021-12-19T03:29:57,261 copying peleffy/solvent/solvent.py -> build/lib/peleffy/solvent 2021-12-19T03:29:57,271 creating build/lib/peleffy/topology 2021-12-19T03:29:57,273 copying peleffy/topology/alchemistry.py -> build/lib/peleffy/topology 2021-12-19T03:29:57,284 copying peleffy/topology/molecule.py -> build/lib/peleffy/topology 2021-12-19T03:29:57,293 copying peleffy/topology/rotamer.py -> build/lib/peleffy/topology 2021-12-19T03:29:57,302 copying peleffy/topology/elements.py -> build/lib/peleffy/topology 2021-12-19T03:29:57,311 copying peleffy/topology/__init__.py -> build/lib/peleffy/topology 2021-12-19T03:29:57,317 copying peleffy/topology/mapper.py -> build/lib/peleffy/topology 2021-12-19T03:29:57,323 copying peleffy/topology/topology.py -> build/lib/peleffy/topology 2021-12-19T03:29:57,330 copying peleffy/topology/zmatrix.py -> build/lib/peleffy/topology 2021-12-19T03:29:57,337 copying peleffy/topology/conformer.py -> build/lib/peleffy/topology 2021-12-19T03:29:57,347 creating build/lib/peleffy/forcefield 2021-12-19T03:29:57,349 copying peleffy/forcefield/selectors.py -> build/lib/peleffy/forcefield 2021-12-19T03:29:57,356 copying peleffy/forcefield/__init__.py -> build/lib/peleffy/forcefield 2021-12-19T03:29:57,361 copying peleffy/forcefield/parameters.py -> build/lib/peleffy/forcefield 2021-12-19T03:29:57,372 copying peleffy/forcefield/forcefield.py -> build/lib/peleffy/forcefield 2021-12-19T03:29:57,378 copying peleffy/forcefield/calculators.py -> build/lib/peleffy/forcefield 2021-12-19T03:29:57,384 creating build/lib/peleffy/utils 2021-12-19T03:29:57,387 copying peleffy/utils/utils.py -> build/lib/peleffy/utils 2021-12-19T03:29:57,395 copying peleffy/utils/input.py -> build/lib/peleffy/utils 2021-12-19T03:29:57,402 copying peleffy/utils/__init__.py -> build/lib/peleffy/utils 2021-12-19T03:29:57,408 copying peleffy/utils/output.py -> build/lib/peleffy/utils 2021-12-19T03:29:57,415 copying peleffy/utils/toolkits.py -> build/lib/peleffy/utils 2021-12-19T03:29:57,505 creating build/lib/peleffy/data 2021-12-19T03:29:57,506 creating build/lib/peleffy/data/tests 2021-12-19T03:29:57,508 copying peleffy/data/tests/ethylene_error2.pdb -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,513 copying peleffy/data/tests/MET_openff-1.2.1_opls2005_parameters4.json -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,518 copying peleffy/data/tests/ETL_openff-1.2.1_opls2005_parameters2.json -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,523 copying peleffy/data/tests/MAT.mae -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,529 copying peleffy/data/tests/alchemical_mol2.pdb -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,534 copying peleffy/data/tests/OPLS_metz -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,541 copying peleffy/data/tests/MET_openff-1.2.1_parameters.json -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,547 copying peleffy/data/tests/MAT.pdb -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,554 copying peleffy/data/tests/ethylene_error4.pdb -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,558 copying peleffy/data/tests/OPLS_metz_amber -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,563 copying peleffy/data/tests/malz -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,568 copying peleffy/data/tests/ethylene_error1.pdb -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,573 copying peleffy/data/tests/malz_OBCParams.txt -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,578 copying peleffy/data/tests/ETL_ffld_output.txt -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,585 copying peleffy/data/tests/MET_openff-1.2.1_opls2005_parameters5.json -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,591 copying peleffy/data/tests/MET_openff-1.2.1_opls2005_parameters2.json -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,598 copying peleffy/data/tests/alchemical_ligandParams_1.txt -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,605 copying peleffy/data/tests/OPLS_malz -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,611 copying peleffy/data/tests/ligandParams_MAL.txt -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,617 copying peleffy/data/tests/metz_OBCParams.txt -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,621 copying peleffy/data/tests/alchemical_ligandParams_2.txt -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,626 copying peleffy/data/tests/ETL_openff-1.2.1_parameters.json -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,631 copying peleffy/data/tests/alchemical_ligandParams_0.txt -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,636 copying peleffy/data/tests/MET_openff-1.2.1_opls2005_parameters1.json -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,643 copying peleffy/data/tests/alchemical_mol1.pdb -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,649 copying peleffy/data/tests/ETL_solventParamsHCTOBC.txt -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,662 copying peleffy/data/tests/alchemical_1.rot.assign -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,668 copying peleffy/data/tests/MET_parameters_to_string.txt -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,675 copying peleffy/data/tests/metz -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,681 copying peleffy/data/tests/OPLS_etlz -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,688 copying peleffy/data/tests/alchemical_structure.pdb -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,694 copying peleffy/data/tests/etlz_OBCParams.txt -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,701 copying peleffy/data/tests/MET_openff-1.2.1_opls2005_parameters3.json -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,708 copying peleffy/data/tests/ethylene_error3.pdb -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,714 copying peleffy/data/tests/metz_amber -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,720 copying peleffy/data/tests/OXO_ffld_output.txt -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,727 copying peleffy/data/tests/alchemical_0.rot.assign -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,733 copying peleffy/data/tests/MET_opls2005_parameters.json -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,740 copying peleffy/data/tests/etlz -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,746 copying peleffy/data/tests/etlz_amber -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,753 copying peleffy/data/tests/ETL_openff-1.2.1_opls2005_parameters1.json -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,760 copying peleffy/data/tests/MET_ffld_output.txt -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,767 copying peleffy/data/tests/OPLS_etlz_amber -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,773 copying peleffy/data/tests/ligSUV_no_elements1.pdb -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,780 copying peleffy/data/tests/MET_solventParamsHCTOBC.txt -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,793 copying peleffy/data/tests/ligSUV_fixed.pdb -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,801 copying peleffy/data/tests/ethane_noH.pdb -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,807 copying peleffy/data/tests/ligSUV_no_elements2.pdb -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,814 copying peleffy/data/tests/alchemical_2.rot.assign -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,820 copying peleffy/data/tests/MAL_ffld_output.txt -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,828 copying peleffy/data/tests/ligSUV_no_elements3.pdb -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,835 copying peleffy/data/tests/malz_amber -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,842 copying peleffy/data/tests/ETL_opls2005_parameters.json -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,850 copying peleffy/data/tests/unlz -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,858 copying peleffy/data/tests/OLC_ffld_output.txt -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,867 copying peleffy/data/tests/MET_parameters_to_json.json -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,872 copying peleffy/data/tests/ligandParams.txt -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,878 copying peleffy/data/tests/OPLS_malz_amber -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,884 copying peleffy/data/tests/MAL_solventParamsHCTOBC.txt -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,897 copying peleffy/data/tests/CO1_ffld_output.txt -> build/lib/peleffy/data/tests 2021-12-19T03:29:57,905 creating build/lib/peleffy/data/tests/MRO_oleic 2021-12-19T03:29:57,907 copying peleffy/data/tests/MRO_oleic/HEM.pdb -> build/lib/peleffy/data/tests/MRO_oleic 2021-12-19T03:29:57,915 copying peleffy/data/tests/MRO_oleic/MG.pdb -> build/lib/peleffy/data/tests/MRO_oleic 2021-12-19T03:29:57,921 copying peleffy/data/tests/MRO_oleic/OLC.pdb -> build/lib/peleffy/data/tests/MRO_oleic 2021-12-19T03:29:57,929 copying peleffy/data/tests/MRO_oleic/OXO.pdb -> build/lib/peleffy/data/tests/MRO_oleic 2021-12-19T03:29:57,935 creating build/lib/peleffy/data/parameters 2021-12-19T03:29:57,937 copying peleffy/data/parameters/ETH.conformation -> build/lib/peleffy/data/parameters 2021-12-19T03:29:57,944 copying peleffy/data/parameters/f14_sgbnp.param -> build/lib/peleffy/data/parameters 2021-12-19T03:29:57,952 copying peleffy/data/parameters/solventParamsHCTOBC.txt -> build/lib/peleffy/data/parameters 2021-12-19T03:29:57,965 copying peleffy/data/parameters/ETH.dihedral -> build/lib/peleffy/data/parameters 2021-12-19T03:29:57,971 copying peleffy/data/parameters/OBCparam.json -> build/lib/peleffy/data/parameters 2021-12-19T03:29:57,978 copying peleffy/data/parameters/similarity.param -> build/lib/peleffy/data/parameters 2021-12-19T03:29:57,986 creating build/lib/peleffy/data/complexes 2021-12-19T03:29:57,989 copying peleffy/data/complexes/LYS_BNZ.pdb -> build/lib/peleffy/data/complexes 2021-12-19T03:29:58,017 copying peleffy/data/complexes/complex_test.pdb -> build/lib/peleffy/data/complexes 2021-12-19T03:29:58,078 copying peleffy/data/complexes/5XXD_SAM.pdb -> build/lib/peleffy/data/complexes 2021-12-19T03:29:58,137 copying peleffy/data/complexes/LIG1_LIG2.pdb -> build/lib/peleffy/data/complexes 2021-12-19T03:29:58,163 creating build/lib/peleffy/data/ligands 2021-12-19T03:29:58,165 copying peleffy/data/ligands/ethylene.mae -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,171 copying peleffy/data/ligands/toluene.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,177 copying peleffy/data/ligands/ammonium.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,184 copying peleffy/data/ligands/oleic_acid.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,190 copying peleffy/data/ligands/BHP.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,195 copying peleffy/data/ligands/benzene_without_connectivity.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,200 copying peleffy/data/ligands/BHP.mae -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,206 copying peleffy/data/ligands/malonate.mae -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,212 copying peleffy/data/ligands/modified_sidechain.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,218 copying peleffy/data/ligands/trimethylglycine_moved.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,225 copying peleffy/data/ligands/BNZ.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,230 copying peleffy/data/ligands/benzene.mae -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,236 copying peleffy/data/ligands/toluene.mae -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,241 copying peleffy/data/ligands/ligand.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,247 copying peleffy/data/ligands/acetylene.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,252 copying peleffy/data/ligands/trimethylglycine.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,259 copying peleffy/data/ligands/malonate.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,265 copying peleffy/data/ligands/LIG2.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,271 copying peleffy/data/ligands/benzene.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,276 copying peleffy/data/ligands/octafluorocyclobutane.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,281 copying peleffy/data/ligands/benzamidine.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,285 copying peleffy/data/ligands/methane.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,290 copying peleffy/data/ligands/propionic_acid.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,296 copying peleffy/data/ligands/LIG1.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,303 copying peleffy/data/ligands/SAM.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,310 copying peleffy/data/ligands/ethylene.pdb -> build/lib/peleffy/data/ligands 2021-12-19T03:29:58,315 creating build/lib/peleffy/data/forcefields 2021-12-19T03:29:58,317 copying peleffy/data/forcefields/GBSA_OBC2-1.0.offxml -> build/lib/peleffy/data/forcefields 2021-12-19T03:29:58,321 copying peleffy/data/forcefields/GBSA_OBC1-1.0.offxml -> build/lib/peleffy/data/forcefields 2021-12-19T03:29:58,337 UPDATING build/lib/peleffy/_version.py 2021-12-19T03:29:58,341 set build/lib/peleffy/_version.py to '1.4.1' 2021-12-19T03:29:58,349 installing to build/bdist.linux-armv7l/wheel 2021-12-19T03:29:58,349 running install 2021-12-19T03:29:58,351 running install_lib 2021-12-19T03:29:58,359 creating build/bdist.linux-armv7l 2021-12-19T03:29:58,359 creating build/bdist.linux-armv7l/wheel 2021-12-19T03:29:58,363 creating build/bdist.linux-armv7l/wheel/peleffy 2021-12-19T03:29:58,367 creating build/bdist.linux-armv7l/wheel/peleffy/solvent 2021-12-19T03:29:58,369 copying build/lib/peleffy/solvent/__init__.py -> build/bdist.linux-armv7l/wheel/peleffy/solvent 2021-12-19T03:29:58,374 copying build/lib/peleffy/solvent/solvent.py -> build/bdist.linux-armv7l/wheel/peleffy/solvent 2021-12-19T03:29:58,381 creating build/bdist.linux-armv7l/wheel/peleffy/tests 2021-12-19T03:29:58,382 copying build/lib/peleffy/tests/test_solvent.py -> build/bdist.linux-armv7l/wheel/peleffy/tests 2021-12-19T03:29:58,388 copying build/lib/peleffy/tests/utils.py -> build/bdist.linux-armv7l/wheel/peleffy/tests 2021-12-19T03:29:58,395 copying build/lib/peleffy/tests/test_topology.py -> build/bdist.linux-armv7l/wheel/peleffy/tests 2021-12-19T03:29:58,403 copying build/lib/peleffy/tests/test_mapper.py -> build/bdist.linux-armv7l/wheel/peleffy/tests 2021-12-19T03:29:58,408 copying build/lib/peleffy/tests/test_utils.py -> build/bdist.linux-armv7l/wheel/peleffy/tests 2021-12-19T03:29:58,418 copying build/lib/peleffy/tests/test_alchemistry.py -> build/bdist.linux-armv7l/wheel/peleffy/tests 2021-12-19T03:29:58,439 copying build/lib/peleffy/tests/test_integrity.py -> build/bdist.linux-armv7l/wheel/peleffy/tests 2021-12-19T03:29:58,444 copying build/lib/peleffy/tests/__init__.py -> build/bdist.linux-armv7l/wheel/peleffy/tests 2021-12-19T03:29:58,448 copying build/lib/peleffy/tests/test_molecule.py -> build/bdist.linux-armv7l/wheel/peleffy/tests 2021-12-19T03:29:58,456 copying build/lib/peleffy/tests/test_forcefields.py -> build/bdist.linux-armv7l/wheel/peleffy/tests 2021-12-19T03:29:58,464 copying build/lib/peleffy/tests/test_conformers.py -> build/bdist.linux-armv7l/wheel/peleffy/tests 2021-12-19T03:29:58,471 copying build/lib/peleffy/tests/test_rotamers.py -> build/bdist.linux-armv7l/wheel/peleffy/tests 2021-12-19T03:29:58,479 copying build/lib/peleffy/tests/test_main.py -> build/bdist.linux-armv7l/wheel/peleffy/tests 2021-12-19T03:29:58,486 copying build/lib/peleffy/tests/test_templates.py -> build/bdist.linux-armv7l/wheel/peleffy/tests 2021-12-19T03:29:58,493 copying build/lib/peleffy/tests/test_parameters.py -> build/bdist.linux-armv7l/wheel/peleffy/tests 2021-12-19T03:29:58,506 copying build/lib/peleffy/tests/test_toolkits.py -> build/bdist.linux-armv7l/wheel/peleffy/tests 2021-12-19T03:29:58,514 copying build/lib/peleffy/main.py -> build/bdist.linux-armv7l/wheel/peleffy 2021-12-19T03:29:58,521 copying build/lib/peleffy/_version.py -> build/bdist.linux-armv7l/wheel/peleffy 2021-12-19T03:29:58,526 copying build/lib/peleffy/__init__.py -> build/bdist.linux-armv7l/wheel/peleffy 2021-12-19T03:29:58,533 creating build/bdist.linux-armv7l/wheel/peleffy/topology 2021-12-19T03:29:58,535 copying build/lib/peleffy/topology/alchemistry.py -> build/bdist.linux-armv7l/wheel/peleffy/topology 2021-12-19T03:29:58,545 copying build/lib/peleffy/topology/molecule.py -> build/bdist.linux-armv7l/wheel/peleffy/topology 2021-12-19T03:29:58,552 copying build/lib/peleffy/topology/rotamer.py -> build/bdist.linux-armv7l/wheel/peleffy/topology 2021-12-19T03:29:58,561 copying build/lib/peleffy/topology/elements.py -> build/bdist.linux-armv7l/wheel/peleffy/topology 2021-12-19T03:29:58,571 copying build/lib/peleffy/topology/__init__.py -> build/bdist.linux-armv7l/wheel/peleffy/topology 2021-12-19T03:29:58,576 copying build/lib/peleffy/topology/mapper.py -> build/bdist.linux-armv7l/wheel/peleffy/topology 2021-12-19T03:29:58,580 copying build/lib/peleffy/topology/topology.py -> build/bdist.linux-armv7l/wheel/peleffy/topology 2021-12-19T03:29:58,586 copying build/lib/peleffy/topology/zmatrix.py -> build/bdist.linux-armv7l/wheel/peleffy/topology 2021-12-19T03:29:58,592 copying build/lib/peleffy/topology/conformer.py -> build/bdist.linux-armv7l/wheel/peleffy/topology 2021-12-19T03:29:58,600 creating build/bdist.linux-armv7l/wheel/peleffy/template 2021-12-19T03:29:58,602 copying build/lib/peleffy/template/impact.py -> build/bdist.linux-armv7l/wheel/peleffy/template 2021-12-19T03:29:58,612 copying build/lib/peleffy/template/__init__.py -> build/bdist.linux-armv7l/wheel/peleffy/template 2021-12-19T03:29:58,618 creating build/bdist.linux-armv7l/wheel/peleffy/forcefield 2021-12-19T03:29:58,620 copying build/lib/peleffy/forcefield/selectors.py -> build/bdist.linux-armv7l/wheel/peleffy/forcefield 2021-12-19T03:29:58,625 copying build/lib/peleffy/forcefield/__init__.py -> build/bdist.linux-armv7l/wheel/peleffy/forcefield 2021-12-19T03:29:58,629 copying build/lib/peleffy/forcefield/parameters.py -> build/bdist.linux-armv7l/wheel/peleffy/forcefield 2021-12-19T03:29:58,640 copying build/lib/peleffy/forcefield/forcefield.py -> build/bdist.linux-armv7l/wheel/peleffy/forcefield 2021-12-19T03:29:58,648 copying build/lib/peleffy/forcefield/calculators.py -> build/bdist.linux-armv7l/wheel/peleffy/forcefield 2021-12-19T03:29:58,656 creating build/bdist.linux-armv7l/wheel/peleffy/utils 2021-12-19T03:29:58,658 copying build/lib/peleffy/utils/utils.py -> build/bdist.linux-armv7l/wheel/peleffy/utils 2021-12-19T03:29:58,666 copying build/lib/peleffy/utils/input.py -> build/bdist.linux-armv7l/wheel/peleffy/utils 2021-12-19T03:29:58,673 copying build/lib/peleffy/utils/__init__.py -> build/bdist.linux-armv7l/wheel/peleffy/utils 2021-12-19T03:29:58,678 copying build/lib/peleffy/utils/output.py -> build/bdist.linux-armv7l/wheel/peleffy/utils 2021-12-19T03:29:58,684 copying build/lib/peleffy/utils/toolkits.py -> build/bdist.linux-armv7l/wheel/peleffy/utils 2021-12-19T03:29:58,693 creating build/bdist.linux-armv7l/wheel/peleffy/data 2021-12-19T03:29:58,699 creating build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,702 copying build/lib/peleffy/data/tests/ethylene_error2.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,708 copying build/lib/peleffy/data/tests/MET_openff-1.2.1_opls2005_parameters4.json -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,714 copying build/lib/peleffy/data/tests/ETL_openff-1.2.1_opls2005_parameters2.json -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,720 copying build/lib/peleffy/data/tests/MAT.mae -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,725 copying build/lib/peleffy/data/tests/alchemical_mol2.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,729 copying build/lib/peleffy/data/tests/OPLS_metz -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,733 copying build/lib/peleffy/data/tests/MET_openff-1.2.1_parameters.json -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,738 copying build/lib/peleffy/data/tests/MAT.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,743 copying build/lib/peleffy/data/tests/ethylene_error4.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,748 copying build/lib/peleffy/data/tests/OPLS_metz_amber -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,754 copying build/lib/peleffy/data/tests/malz -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,759 copying build/lib/peleffy/data/tests/ethylene_error1.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,763 copying build/lib/peleffy/data/tests/malz_OBCParams.txt -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,767 copying build/lib/peleffy/data/tests/ETL_ffld_output.txt -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,772 copying build/lib/peleffy/data/tests/MET_openff-1.2.1_opls2005_parameters5.json -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,776 copying build/lib/peleffy/data/tests/MET_openff-1.2.1_opls2005_parameters2.json -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,781 copying build/lib/peleffy/data/tests/alchemical_ligandParams_1.txt -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,787 copying build/lib/peleffy/data/tests/OPLS_malz -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,792 copying build/lib/peleffy/data/tests/ligandParams_MAL.txt -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,798 copying build/lib/peleffy/data/tests/metz_OBCParams.txt -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,802 copying build/lib/peleffy/data/tests/alchemical_ligandParams_2.txt -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,807 copying build/lib/peleffy/data/tests/ETL_openff-1.2.1_parameters.json -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,811 copying build/lib/peleffy/data/tests/alchemical_ligandParams_0.txt -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,816 copying build/lib/peleffy/data/tests/MET_openff-1.2.1_opls2005_parameters1.json -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,820 copying build/lib/peleffy/data/tests/alchemical_mol1.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,825 copying build/lib/peleffy/data/tests/ETL_solventParamsHCTOBC.txt -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,837 copying build/lib/peleffy/data/tests/alchemical_1.rot.assign -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,842 copying build/lib/peleffy/data/tests/MET_parameters_to_string.txt -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,847 copying build/lib/peleffy/data/tests/metz -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,851 copying build/lib/peleffy/data/tests/OPLS_etlz -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,855 copying build/lib/peleffy/data/tests/alchemical_structure.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,859 copying build/lib/peleffy/data/tests/etlz_OBCParams.txt -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,864 copying build/lib/peleffy/data/tests/MET_openff-1.2.1_opls2005_parameters3.json -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,869 copying build/lib/peleffy/data/tests/ethylene_error3.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,875 copying build/lib/peleffy/data/tests/metz_amber -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,880 copying build/lib/peleffy/data/tests/OXO_ffld_output.txt -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,884 copying build/lib/peleffy/data/tests/alchemical_0.rot.assign -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,888 copying build/lib/peleffy/data/tests/MET_opls2005_parameters.json -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,892 copying build/lib/peleffy/data/tests/etlz -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,897 copying build/lib/peleffy/data/tests/etlz_amber -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,902 creating build/bdist.linux-armv7l/wheel/peleffy/data/tests/MRO_oleic 2021-12-19T03:29:58,905 copying build/lib/peleffy/data/tests/MRO_oleic/HEM.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/tests/MRO_oleic 2021-12-19T03:29:58,912 copying build/lib/peleffy/data/tests/MRO_oleic/MG.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/tests/MRO_oleic 2021-12-19T03:29:58,917 copying build/lib/peleffy/data/tests/MRO_oleic/OLC.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/tests/MRO_oleic 2021-12-19T03:29:58,923 copying build/lib/peleffy/data/tests/MRO_oleic/OXO.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/tests/MRO_oleic 2021-12-19T03:29:58,927 copying build/lib/peleffy/data/tests/ETL_openff-1.2.1_opls2005_parameters1.json -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,932 copying build/lib/peleffy/data/tests/MET_ffld_output.txt -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,936 copying build/lib/peleffy/data/tests/OPLS_etlz_amber -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,940 copying build/lib/peleffy/data/tests/ligSUV_no_elements1.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,945 copying build/lib/peleffy/data/tests/MET_solventParamsHCTOBC.txt -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,958 copying build/lib/peleffy/data/tests/ligSUV_fixed.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,964 copying build/lib/peleffy/data/tests/ethane_noH.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,968 copying build/lib/peleffy/data/tests/ligSUV_no_elements2.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,973 copying build/lib/peleffy/data/tests/alchemical_2.rot.assign -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,977 copying build/lib/peleffy/data/tests/MAL_ffld_output.txt -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,982 copying build/lib/peleffy/data/tests/ligSUV_no_elements3.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,988 copying build/lib/peleffy/data/tests/malz_amber -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,993 copying build/lib/peleffy/data/tests/ETL_opls2005_parameters.json -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:58,1000 copying build/lib/peleffy/data/tests/unlz -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:59,005 copying build/lib/peleffy/data/tests/OLC_ffld_output.txt -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:59,014 copying build/lib/peleffy/data/tests/MET_parameters_to_json.json -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:59,018 copying build/lib/peleffy/data/tests/ligandParams.txt -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:59,023 copying build/lib/peleffy/data/tests/OPLS_malz_amber -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:59,029 copying build/lib/peleffy/data/tests/MAL_solventParamsHCTOBC.txt -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:59,041 copying build/lib/peleffy/data/tests/CO1_ffld_output.txt -> build/bdist.linux-armv7l/wheel/peleffy/data/tests 2021-12-19T03:29:59,048 creating build/bdist.linux-armv7l/wheel/peleffy/data/parameters 2021-12-19T03:29:59,050 copying build/lib/peleffy/data/parameters/ETH.conformation -> build/bdist.linux-armv7l/wheel/peleffy/data/parameters 2021-12-19T03:29:59,054 copying build/lib/peleffy/data/parameters/f14_sgbnp.param -> build/bdist.linux-armv7l/wheel/peleffy/data/parameters 2021-12-19T03:29:59,059 copying build/lib/peleffy/data/parameters/solventParamsHCTOBC.txt -> build/bdist.linux-armv7l/wheel/peleffy/data/parameters 2021-12-19T03:29:59,070 copying build/lib/peleffy/data/parameters/ETH.dihedral -> build/bdist.linux-armv7l/wheel/peleffy/data/parameters 2021-12-19T03:29:59,076 copying build/lib/peleffy/data/parameters/OBCparam.json -> build/bdist.linux-armv7l/wheel/peleffy/data/parameters 2021-12-19T03:29:59,081 copying build/lib/peleffy/data/parameters/similarity.param -> build/bdist.linux-armv7l/wheel/peleffy/data/parameters 2021-12-19T03:29:59,089 creating build/bdist.linux-armv7l/wheel/peleffy/data/complexes 2021-12-19T03:29:59,092 copying build/lib/peleffy/data/complexes/LYS_BNZ.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/complexes 2021-12-19T03:29:59,117 copying build/lib/peleffy/data/complexes/complex_test.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/complexes 2021-12-19T03:29:59,178 copying build/lib/peleffy/data/complexes/5XXD_SAM.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/complexes 2021-12-19T03:29:59,239 copying build/lib/peleffy/data/complexes/LIG1_LIG2.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/complexes 2021-12-19T03:29:59,269 creating build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,273 copying build/lib/peleffy/data/ligands/ethylene.mae -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,281 copying build/lib/peleffy/data/ligands/toluene.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,288 copying build/lib/peleffy/data/ligands/ammonium.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,293 copying build/lib/peleffy/data/ligands/oleic_acid.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,299 copying build/lib/peleffy/data/ligands/BHP.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,304 copying build/lib/peleffy/data/ligands/benzene_without_connectivity.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,309 copying build/lib/peleffy/data/ligands/BHP.mae -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,315 copying build/lib/peleffy/data/ligands/malonate.mae -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,320 copying build/lib/peleffy/data/ligands/modified_sidechain.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,325 copying build/lib/peleffy/data/ligands/trimethylglycine_moved.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,330 copying build/lib/peleffy/data/ligands/BNZ.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,334 copying build/lib/peleffy/data/ligands/benzene.mae -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,340 copying build/lib/peleffy/data/ligands/toluene.mae -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,346 copying build/lib/peleffy/data/ligands/ligand.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,351 copying build/lib/peleffy/data/ligands/acetylene.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,358 copying build/lib/peleffy/data/ligands/trimethylglycine.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,363 copying build/lib/peleffy/data/ligands/malonate.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,369 copying build/lib/peleffy/data/ligands/LIG2.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,375 copying build/lib/peleffy/data/ligands/benzene.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,381 copying build/lib/peleffy/data/ligands/octafluorocyclobutane.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,386 copying build/lib/peleffy/data/ligands/benzamidine.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,392 copying build/lib/peleffy/data/ligands/methane.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,396 copying build/lib/peleffy/data/ligands/propionic_acid.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,400 copying build/lib/peleffy/data/ligands/LIG1.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,405 copying build/lib/peleffy/data/ligands/SAM.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,410 copying build/lib/peleffy/data/ligands/ethylene.pdb -> build/bdist.linux-armv7l/wheel/peleffy/data/ligands 2021-12-19T03:29:59,416 creating build/bdist.linux-armv7l/wheel/peleffy/data/forcefields 2021-12-19T03:29:59,418 copying build/lib/peleffy/data/forcefields/GBSA_OBC2-1.0.offxml -> build/bdist.linux-armv7l/wheel/peleffy/data/forcefields 2021-12-19T03:29:59,424 copying build/lib/peleffy/data/forcefields/GBSA_OBC1-1.0.offxml -> build/bdist.linux-armv7l/wheel/peleffy/data/forcefields 2021-12-19T03:29:59,429 running install_egg_info 2021-12-19T03:29:59,467 running egg_info 2021-12-19T03:29:59,469 writing peleffy.egg-info/PKG-INFO 2021-12-19T03:29:59,473 writing top-level names to peleffy.egg-info/top_level.txt 2021-12-19T03:29:59,476 writing dependency_links to peleffy.egg-info/dependency_links.txt 2021-12-19T03:29:59,500 reading manifest file 'peleffy.egg-info/SOURCES.txt' 2021-12-19T03:29:59,512 reading manifest template 'MANIFEST.in' 2021-12-19T03:29:59,537 writing manifest file 'peleffy.egg-info/SOURCES.txt' 2021-12-19T03:29:59,541 Copying peleffy.egg-info to build/bdist.linux-armv7l/wheel/peleffy-1.4.1-py3.5.egg-info 2021-12-19T03:29:59,560 running install_scripts 2021-12-19T03:29:59,734 creating build/bdist.linux-armv7l/wheel/peleffy-1.4.1.dist-info/WHEEL 2021-12-19T03:30:01,162 Building wheel for peleffy (setup.py): finished with status 'done' 2021-12-19T03:30:01,176 Created wheel for peleffy: filename=peleffy-1.4.1-py3-none-any.whl size=621891 sha256=37ffa36a2c02877a499c641ed2617a539b634a6c740a65d30b1c66e3c57d6543 2021-12-19T03:30:01,177 Stored in directory: /tmp/pip-ephem-wheel-cache-m4y556q4/wheels/3d/9d/23/8e5914c9b89911ef5874f0f51e4ee6b6befb6caeb30f9bbf88 2021-12-19T03:30:01,209 Successfully built peleffy 2021-12-19T03:30:01,321 Removed build tracker: '/tmp/pip-req-tracker-edom31a6'