Task 38582221
| Name | PFKFB3_A18_A03_r0_1-QUICO_ATM_GAFF2_LOMAP_PFKFB3-1-5-RND5273_0 |
| Workunit | 31546564 |
| Created | 12 Dec 2025, 23:35:28 UTC |
| Sent | 12 Dec 2025, 23:35:29 UTC |
| Report deadline | 17 Dec 2025, 23:35:29 UTC |
| Received | 18 Dec 2025, 15:19:41 UTC |
| Server state | Over |
| Outcome | Success |
| Client state | Done |
| Exit status | 0 (0x00000000) |
| Computer ID | 632304 |
| Run time | 6 hours 19 min 54 sec |
| CPU time | 5 hours 52 min 49 sec |
| Validate state | Task was reported too late to validate |
| Credit | 0.00 |
| Device peak FLOPS | 44,611.33 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 745.59 MB |
| Peak swap size | 5.58 GB |
| Peak disk usage | 4.81 GB |
Stderr output
<core_client_version>8.0.2</core_client_version>
<![CDATA[
<stderr_txt>
06:44:29 (18904): wrapper (7.9.26016): starting
06:44:29 (18904): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A18_A03_0.pdb
QB_A18_A03_0.xml
QB_A18_A03_equil.pdb
QB_A18_A03.inpcrd
QB_A18_A03_input.yaml
QB_A18_A03_mdlambda.pdb
QB_A18_A03_min.pdb
QB_A18_A03_npt.pdb
QB_A18_A03.pdb
QB_A18_A03.prmtop
QB_A18_A03_sys.xml
QB_A18_A03_therm.pdb
run.bat
run.sh
06:44:45 (18904): Library/usr/bin/tar.exe exited; CPU time 0.187500
06:44:45 (18904): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
WARNING: The script pyaml.exe is installed in 'C:\ProgramData\BOINC\slots\0\Scripts' which is not on PATH.
Consider adding this directory to PATH or, if you prefer to suppress this warning, use --no-warn-script-location.
Running command pip subprocess to install build dependencies
Using pip 24.3.1 from C:\ProgramData\BOINC\slots\0\Lib\site-packages\pip (python 3.11)
Collecting setuptools
Obtaining dependency information for setuptools from https://files.pythonhosted.org/packages/a3/dc/17031897dae0efacfea57dfd3a82fdd2a2aeb58e0ff71b77b87e44edc772/setuptools-80.9.0-py3-none-any.whl.metadata
Using cached setuptools-80.9.0-py3-none-any.whl.metadata (6.6 kB)
Collecting setuptools-scm>=8
Obtaining dependency information for setuptools-scm>=8 from https://files.pythonhosted.org/packages/3d/ea/ac2bf868899d0d2e82ef72d350d97a846110c709bacf2d968431576ca915/setuptools_scm-9.2.2-py3-none-any.whl.metadata
Downloading setuptools_scm-9.2.2-py3-none-any.whl.metadata (7.7 kB)
Collecting packaging>=20 (from setuptools-scm>=8)
Obtaining dependency information for packaging>=20 from https://files.pythonhosted.org/packages/20/12/38679034af332785aac8774540895e234f4d07f7545804097de4b666afd8/packaging-25.0-py3-none-any.whl.metadata
Using cached packaging-25.0-py3-none-any.whl.metadata (3.3 kB)
Using cached setuptools-80.9.0-py3-none-any.whl (1.2 MB)
Downloading setuptools_scm-9.2.2-py3-none-any.whl (62 kB)
Using cached packaging-25.0-py3-none-any.whl (66 kB)
Installing collected packages: setuptools, packaging, setuptools-scm
Creating C:\ProgramData\BOINC\slots\0\pip-build-env-jrk3gy8o\overlay\Scripts
Successfully installed packaging-25.0 setuptools-80.9.0 setuptools-scm-9.2.2
Running command Getting requirements to build wheel
C:\ProgramData\BOINC\slots\0\pip-build-env-jrk3gy8o\overlay\Lib\site-packages\setuptools_scm\_integration\version_inference.py:51: UserWarning: version of None already set
warnings.warn(self.message)
running egg_info
writing atom_openmm.egg-info\PKG-INFO
writing dependency_links to atom_openmm.egg-info\dependency_links.txt
writing entry points to atom_openmm.egg-info\entry_points.txt
writing requirements to atom_openmm.egg-info\requires.txt
writing top-level names to atom_openmm.egg-info\top_level.txt
listing git files failed - pretending there aren't any
reading manifest file 'atom_openmm.egg-info\SOURCES.txt'
reading manifest template 'MANIFEST.in'
adding license file 'LICENSE'
writing manifest file 'atom_openmm.egg-info\SOURCES.txt'
Running command Preparing metadata (pyproject.toml)
C:\ProgramData\BOINC\slots\0\pip-build-env-jrk3gy8o\overlay\Lib\site-packages\setuptools_scm\_integration\version_inference.py:51: UserWarning: version of None already set
warnings.warn(self.message)
running dist_info
creating C:\ProgramData\BOINC\slots\0\pip-modern-metadata-pl0h3i3d\atom_openmm.egg-info
writing C:\ProgramData\BOINC\slots\0\pip-modern-metadata-pl0h3i3d\atom_openmm.egg-info\PKG-INFO
writing dependency_links to C:\ProgramData\BOINC\slots\0\pip-modern-metadata-pl0h3i3d\atom_openmm.egg-info\dependency_links.txt
writing entry points to C:\ProgramData\BOINC\slots\0\pip-modern-metadata-pl0h3i3d\atom_openmm.egg-info\entry_points.txt
writing requirements to C:\ProgramData\BOINC\slots\0\pip-modern-metadata-pl0h3i3d\atom_openmm.egg-info\requires.txt
writing top-level names to C:\ProgramData\BOINC\slots\0\pip-modern-metadata-pl0h3i3d\atom_openmm.egg-info\top_level.txt
writing manifest file 'C:\ProgramData\BOINC\slots\0\pip-modern-metadata-pl0h3i3d\atom_openmm.egg-info\SOURCES.txt'
listing git files failed - pretending there aren't any
reading manifest file 'C:\ProgramData\BOINC\slots\0\pip-modern-metadata-pl0h3i3d\atom_openmm.egg-info\SOURCES.txt'
reading manifest template 'MANIFEST.in'
adding license file 'LICENSE'
writing manifest file 'C:\ProgramData\BOINC\slots\0\pip-modern-metadata-pl0h3i3d\atom_openmm.egg-info\SOURCES.txt'
creating 'C:\ProgramData\BOINC\slots\0\pip-modern-metadata-pl0h3i3d\atom_openmm-8.4.0.dist-info'
Running command Building wheel for atom-openmm (pyproject.toml)
C:\ProgramData\BOINC\slots\0\pip-build-env-jrk3gy8o\overlay\Lib\site-packages\setuptools_scm\_integration\version_inference.py:51: UserWarning: version of None already set
warnings.warn(self.message)
running bdist_wheel
running build
running build_py
creating build\lib\atom_openmm
copying atom_openmm\abfe_explicit.py -> build\lib\atom_openmm
copying atom_openmm\abfe_production.py -> build\lib\atom_openmm
copying atom_openmm\abfe_structprep.py -> build\lib\atom_openmm
copying atom_openmm\async_re.py -> build\lib\atom_openmm
copying atom_openmm\gibbs_sampling.py -> build\lib\atom_openmm
copying atom_openmm\local_openmm_transport.py -> build\lib\atom_openmm
copying atom_openmm\make_atm_system_from_amber.py -> build\lib\atom_openmm
copying atom_openmm\make_atm_system_from_pdb.py -> build\lib\atom_openmm
copying atom_openmm\make_atm_system_from_rcpt_lig.py -> build\lib\atom_openmm
copying atom_openmm\ommreplica.py -> build\lib\atom_openmm
copying atom_openmm\ommsystem.py -> build\lib\atom_openmm
copying atom_openmm\ommworker.py -> build\lib\atom_openmm
copying atom_openmm\openmm_async_re.py -> build\lib\atom_openmm
copying atom_openmm\rbfe_explicit.py -> build\lib\atom_openmm
copying atom_openmm\rbfe_production.py -> build\lib\atom_openmm
copying atom_openmm\rbfe_structprep.py -> build\lib\atom_openmm
copying atom_openmm\temperatureRE_explicit.py -> build\lib\atom_openmm
copying atom_openmm\transport.py -> build\lib\atom_openmm
copying atom_openmm\uwham.py -> build\lib\atom_openmm
copying atom_openmm\__init__.py -> build\lib\atom_openmm
creating build\lib\atom_openmm\utils
copying atom_openmm\utils\AtomUtils.py -> build\lib\atom_openmm\utils
copying atom_openmm\utils\config.py -> build\lib\atom_openmm\utils
copying atom_openmm\utils\singal_guard.py -> build\lib\atom_openmm\utils
copying atom_openmm\utils\timer.py -> build\lib\atom_openmm\utils
copying atom_openmm\utils\__init__.py -> build\lib\atom_openmm\utils
running egg_info
writing atom_openmm.egg-info\PKG-INFO
writing dependency_links to atom_openmm.egg-info\dependency_links.txt
writing entry points to atom_openmm.egg-info\entry_points.txt
writing requirements to atom_openmm.egg-info\requires.txt
writing top-level names to atom_openmm.egg-info\top_level.txt
listing git files failed - pretending there aren't any
reading manifest file 'atom_openmm.egg-info\SOURCES.txt'
reading manifest template 'MANIFEST.in'
adding license file 'LICENSE'
writing manifest file 'atom_openmm.egg-info\SOURCES.txt'
copying atom_openmm\utils\logging.conf -> build\lib\atom_openmm\utils
installing to build\bdist.win-amd64\wheel
running install
running install_lib
creating build\bdist.win-amd64\wheel
creating build\bdist.win-amd64\wheel\atom_openmm
copying build\lib\atom_openmm\abfe_explicit.py -> build\bdist.win-amd64\wheel\.\atom_openmm
copying build\lib\atom_openmm\abfe_production.py -> build\bdist.win-amd64\wheel\.\atom_openmm
copying build\lib\atom_openmm\abfe_structprep.py -> build\bdist.win-amd64\wheel\.\atom_openmm
copying build\lib\atom_openmm\async_re.py -> build\bdist.win-amd64\wheel\.\atom_openmm
copying build\lib\atom_openmm\gibbs_sampling.py -> build\bdist.win-amd64\wheel\.\atom_openmm
copying build\lib\atom_openmm\local_openmm_transport.py -> build\bdist.win-amd64\wheel\.\atom_openmm
copying build\lib\atom_openmm\make_atm_system_from_amber.py -> build\bdist.win-amd64\wheel\.\atom_openmm
copying build\lib\atom_openmm\make_atm_system_from_pdb.py -> build\bdist.win-amd64\wheel\.\atom_openmm
copying build\lib\atom_openmm\make_atm_system_from_rcpt_lig.py -> build\bdist.win-amd64\wheel\.\atom_openmm
copying build\lib\atom_openmm\ommreplica.py -> build\bdist.win-amd64\wheel\.\atom_openmm
copying build\lib\atom_openmm\ommsystem.py -> build\bdist.win-amd64\wheel\.\atom_openmm
copying build\lib\atom_openmm\ommworker.py -> build\bdist.win-amd64\wheel\.\atom_openmm
copying build\lib\atom_openmm\openmm_async_re.py -> build\bdist.win-amd64\wheel\.\atom_openmm
copying build\lib\atom_openmm\rbfe_explicit.py -> build\bdist.win-amd64\wheel\.\atom_openmm
copying build\lib\atom_openmm\rbfe_production.py -> build\bdist.win-amd64\wheel\.\atom_openmm
copying build\lib\atom_openmm\rbfe_structprep.py -> build\bdist.win-amd64\wheel\.\atom_openmm
copying build\lib\atom_openmm\temperatureRE_explicit.py -> build\bdist.win-amd64\wheel\.\atom_openmm
copying build\lib\atom_openmm\transport.py -> build\bdist.win-amd64\wheel\.\atom_openmm
creating build\bdist.win-amd64\wheel\atom_openmm\utils
copying build\lib\atom_openmm\utils\AtomUtils.py -> build\bdist.win-amd64\wheel\.\atom_openmm\utils
copying build\lib\atom_openmm\utils\config.py -> build\bdist.win-amd64\wheel\.\atom_openmm\utils
copying build\lib\atom_openmm\utils\logging.conf -> build\bdist.win-amd64\wheel\.\atom_openmm\utils
copying build\lib\atom_openmm\utils\singal_guard.py -> build\bdist.win-amd64\wheel\.\atom_openmm\utils
copying build\lib\atom_openmm\utils\timer.py -> build\bdist.win-amd64\wheel\.\atom_openmm\utils
copying build\lib\atom_openmm\utils\__init__.py -> build\bdist.win-amd64\wheel\.\atom_openmm\utils
copying build\lib\atom_openmm\uwham.py -> build\bdist.win-amd64\wheel\.\atom_openmm
copying build\lib\atom_openmm\__init__.py -> build\bdist.win-amd64\wheel\.\atom_openmm
running install_egg_info
Copying atom_openmm.egg-info to build\bdist.win-amd64\wheel\.\atom_openmm-8.4.0-py3.11.egg-info
running install_scripts
creating build\bdist.win-amd64\wheel\atom_openmm-8.4.0.dist-info\WHEEL
creating 'C:\ProgramData\BOINC\slots\0\pip-wheel-9oyn_ogg\.tmp-eu81dxns\atom_openmm-8.4.0-py3-none-any.whl' and adding 'build\bdist.win-amd64\wheel' to it
adding 'atom_openmm/__init__.py'
adding 'atom_openmm/abfe_explicit.py'
adding 'atom_openmm/abfe_production.py'
adding 'atom_openmm/abfe_structprep.py'
adding 'atom_openmm/async_re.py'
adding 'atom_openmm/gibbs_sampling.py'
adding 'atom_openmm/local_openmm_transport.py'
adding 'atom_openmm/make_atm_system_from_amber.py'
adding 'atom_openmm/make_atm_system_from_pdb.py'
adding 'atom_openmm/make_atm_system_from_rcpt_lig.py'
adding 'atom_openmm/ommreplica.py'
adding 'atom_openmm/ommsystem.py'
adding 'atom_openmm/ommworker.py'
adding 'atom_openmm/openmm_async_re.py'
adding 'atom_openmm/rbfe_explicit.py'
adding 'atom_openmm/rbfe_production.py'
adding 'atom_openmm/rbfe_structprep.py'
adding 'atom_openmm/temperatureRE_explicit.py'
adding 'atom_openmm/transport.py'
adding 'atom_openmm/uwham.py'
adding 'atom_openmm/utils/AtomUtils.py'
adding 'atom_openmm/utils/__init__.py'
adding 'atom_openmm/utils/config.py'
adding 'atom_openmm/utils/logging.conf'
adding 'atom_openmm/utils/singal_guard.py'
adding 'atom_openmm/utils/timer.py'
adding 'atom_openmm-8.4.0.dist-info/licenses/LICENSE'
adding 'atom_openmm-8.4.0.dist-info/METADATA'
adding 'atom_openmm-8.4.0.dist-info/WHEEL'
adding 'atom_openmm-8.4.0.dist-info/entry_points.txt'
adding 'atom_openmm-8.4.0.dist-info/top_level.txt'
adding 'atom_openmm-8.4.0.dist-info/RECORD'
removing build\bdist.win-amd64\wheel
WARNING: The scripts abfe_production.exe, abfe_structprep.exe, make_atm_system_from_amber.exe, make_atm_system_from_pdb.exe, make_atm_system_from_rcpt_lig.exe, rbfe_production.exe and rbfe_structprep.exe are installed in 'C:\ProgramData\BOINC\slots\0\Scripts' which is not on PATH.
Consider adding this directory to PATH or, if you prefer to suppress this warning, use --no-warn-script-location.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {3835194} normal block at 0x0000016F7659E300, 8 bytes long.
Data: < vo > 00 00 A7 76 6F 01 00 00
..\lib\diagnostics_win.cpp(417) : {3833964} normal block at 0x0000016F78347BA0, 1080 bytes long.
Data: <d) > 64 29 00 00 CD CD CD CD A8 02 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {314} normal block at 0x0000016F76596370, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
06:53:59 (2392): wrapper (7.9.26016): starting
06:53:59 (2392): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {3849877} normal block at 0x0000020A38D0D870, 8 bytes long.
Data: < !9 > 00 00 21 39 0A 02 00 00
..\lib\diagnostics_win.cpp(417) : {3848647} normal block at 0x0000020A3A9EE2F0, 1080 bytes long.
Data: < N > A4 4E 00 00 CD CD CD CD EC 02 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {314} normal block at 0x0000020A38D017A0, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
13:42:54 (18444): wrapper (7.9.26016): starting
13:42:54 (18444): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {3849877} normal block at 0x000001BE0E58D2C0, 8 bytes long.
Data: < 0 > 00 00 30 10 BE 01 00 00
..\lib\diagnostics_win.cpp(417) : {3848647} normal block at 0x000001BE0E57D870, 1080 bytes long.
Data: <T> > 54 3E 00 00 CD CD CD CD CC 03 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {314} normal block at 0x000001BE0E581C00, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
14:41:29 (13168): wrapper (7.9.26016): starting
14:41:29 (13168): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {3849876} normal block at 0x0000028516AAD8D0, 8 bytes long.
Data: < L > 00 00 4C 18 85 02 00 00
..\lib\diagnostics_win.cpp(417) : {3848646} normal block at 0x0000028516A9D870, 1080 bytes long.
Data: < > F0 1E 00 00 CD CD CD CD EC 02 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {314} normal block at 0x0000028516AA0B20, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
14:57:00 (18124): wrapper (7.9.26016): starting
14:57:00 (18124): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {3849877} normal block at 0x000002C2EBCDDF60, 8 bytes long.
Data: < > 00 00 17 EC C2 02 00 00
..\lib\diagnostics_win.cpp(417) : {3848647} normal block at 0x000002C2EBCCD870, 1080 bytes long.
Data: < > 14 1F 00 00 CD CD CD CD A8 02 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {314} normal block at 0x000002C2EBCD1660, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
15:10:16 (3104): wrapper (7.9.26016): starting
15:10:16 (3104): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {3849877} normal block at 0x00000294D1A8DF60, 8 bytes long.
Data: < > 00 00 03 D2 94 02 00 00
..\lib\diagnostics_win.cpp(417) : {3848647} normal block at 0x00000294D1A7D870, 1080 bytes long.
Data: < W , > 18 57 00 00 CD CD CD CD 2C 02 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {314} normal block at 0x00000294D1A81160, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
17:11:47 (12748): wrapper (7.9.26016): starting
17:11:47 (12748): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {3849877} normal block at 0x0000025CD5EEE0A0, 8 bytes long.
Data: < \ > 00 00 94 D7 5C 02 00 00
..\lib\diagnostics_win.cpp(417) : {3848647} normal block at 0x0000025CD5EDD870, 1080 bytes long.
Data: < ( > D0 28 00 00 CD CD CD CD A4 02 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {314} normal block at 0x0000025CD5EE0DA0, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
19:21:35 (8268): wrapper (7.9.26016): starting
19:21:35 (8268): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {3849877} normal block at 0x000001E56F4DDDD0, 8 bytes long.
Data: < Ko > 00 00 4B 6F E5 01 00 00
..\lib\diagnostics_win.cpp(417) : {3848647} normal block at 0x000001E56F4CD870, 1080 bytes long.
Data: <,3 > 2C 33 00 00 CD CD CD CD D4 02 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {314} normal block at 0x000001E56F4D09E0, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
20:00:13 (316): wrapper (7.9.26016): starting
20:00:13 (316): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {3849877} normal block at 0x00000283F637D4C0, 8 bytes long.
Data: < > 00 00 7F F6 83 02 00 00
..\lib\diagnostics_win.cpp(417) : {3848647} normal block at 0x00000283F636D870, 1080 bytes long.
Data: <`M > 60 4D 00 00 CD CD CD CD D4 01 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {314} normal block at 0x00000283F6370DA0, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
21:34:42 (8048): wrapper (7.9.26016): starting
21:34:42 (8048): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {3849877} normal block at 0x00000199BCD4DA60, 8 bytes long.
Data: < ( > 00 00 28 BD 99 01 00 00
..\lib\diagnostics_win.cpp(417) : {3848647} normal block at 0x00000199BCD3D870, 1080 bytes long.
Data: < @ > C0 40 00 00 CD CD CD CD E8 02 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {314} normal block at 0x00000199BCD412A0, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
09:12:47 (14680): wrapper (7.9.26016): starting
09:12:47 (14680): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {3849877} normal block at 0x000001F1E5AED860, 8 bytes long.
Data: < > 00 00 AC E5 F1 01 00 00
..\lib\diagnostics_win.cpp(417) : {3848647} normal block at 0x000001F1E5ADD870, 1080 bytes long.
Data: < ) > AC 29 00 00 CD CD CD CD B4 00 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {314} normal block at 0x000001F1E5AE1500, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
10:22:40 (12568): wrapper (7.9.26016): starting
10:22:40 (12568): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {3849877} normal block at 0x000002AA8E31D3F0, 8 bytes long.
Data: < > 00 00 88 8E AA 02 00 00
..\lib\diagnostics_win.cpp(417) : {3848647} normal block at 0x000002AA8E30D870, 1080 bytes long.
Data: <$V > 24 56 00 00 CD CD CD CD E4 03 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {314} normal block at 0x000002AA8E30FAE0, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
11:57:36 (8240): wrapper (7.9.26016): starting
11:57:36 (8240): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
tar: run.log: file changed as we read it
tar: r*/*.dcd: Cannot stat: No such file or directory
tar: Exiting with failure status due to previous errors
15:06:23 (8240): C:/Windows/system32/cmd.exe exited; CPU time 10958.984375
15:06:23 (8240): called boinc_finish(0)
0 bytes in 0 Free Blocks.
256 bytes in 6 Normal Blocks.
1144 bytes in 1 CRT Blocks.
0 bytes in 0 Ignore Blocks.
0 bytes in 0 Client Blocks.
Largest number used: 0 bytes.
Total allocations: 172773234 bytes.
Dumping objects ->
{3849965} normal block at 0x000002097C3ED6F0, 48 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3849954} normal block at 0x000002097C3EDDF0, 48 bytes long.
Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3849943} normal block at 0x000002097C3ED5A0, 48 bytes long.
Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61
{3849932} normal block at 0x000002097A814F80, 48 bytes long.
Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3849921} normal block at 0x000002097A814F10, 48 bytes long.
Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61
{3849890} normal block at 0x000002097C4352B0, 64 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
..\api\boinc_api.cpp(309) : {3849877} normal block at 0x000002097A80D3D0, 8 bytes long.
Data: < "| > 00 00 22 7C 09 02 00 00
{3848648} normal block at 0x000002097A80DB00, 8 bytes long.
Data: <pØ z > 70 D8 7F 7A 09 02 00 00
..\zip\boinc_zip.cpp(122) : {314} normal block at 0x000002097A801520, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{299} normal block at 0x000002097A8019F0, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
{298} normal block at 0x000002097A815DD0, 16 bytes long.
Data: <hk z > 68 6B 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{297} normal block at 0x000002097A816280, 16 bytes long.
Data: <@k z > 40 6B 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{296} normal block at 0x000002097A811F00, 32 bytes long.
Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D
{295} normal block at 0x000002097A816230, 16 bytes long.
Data: < k z > 18 6B 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{294} normal block at 0x000002097A815B50, 16 bytes long.
Data: <ðj z > F0 6A 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{293} normal block at 0x000002097A816190, 16 bytes long.
Data: <Èj z > C8 6A 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x000002097A816140, 16 bytes long.
Data: < j z > A0 6A 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{291} normal block at 0x000002097A814B20, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{290} normal block at 0x000002097A816410, 16 bytes long.
Data: <¨ z > A8 08 80 7A 09 02 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x000002097A811EA0, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{288} normal block at 0x000002097A8158D0, 16 bytes long.
Data: < z > 80 08 80 7A 09 02 00 00 00 00 00 00 00 00 00 00
{286} normal block at 0x000002097A815B00, 16 bytes long.
Data: <X z > 58 08 80 7A 09 02 00 00 00 00 00 00 00 00 00 00
{285} normal block at 0x000002097A816000, 16 bytes long.
Data: <0 z > 30 08 80 7A 09 02 00 00 00 00 00 00 00 00 00 00
{284} normal block at 0x000002097A8159C0, 16 bytes long.
Data: < z > 08 08 80 7A 09 02 00 00 00 00 00 00 00 00 00 00
{283} normal block at 0x000002097A816370, 16 bytes long.
Data: <à z > E0 07 80 7A 09 02 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x000002097A816460, 16 bytes long.
Data: <¸ z > B8 07 80 7A 09 02 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x000002097A8112A0, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{280} normal block at 0x000002097A816050, 16 bytes long.
Data: < z > 90 07 80 7A 09 02 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x000002097A800790, 320 bytes long.
Data: <P` z   z > 50 60 81 7A 09 02 00 00 A0 12 81 7A 09 02 00 00
{278} normal block at 0x000002097A816320, 16 bytes long.
Data: < j z > 80 6A 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x000002097A815C90, 16 bytes long.
Data: <Xj z > 58 6A 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{276} normal block at 0x000002097A8118A0, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{275} normal block at 0x000002097A815920, 16 bytes long.
Data: <0j z > 30 6A 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{274} normal block at 0x000002097A811CC0, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{273} normal block at 0x000002097A815880, 16 bytes long.
Data: <xi z > 78 69 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{272} normal block at 0x000002097A815970, 16 bytes long.
Data: <Pi z > 50 69 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{271} normal block at 0x000002097A8161E0, 16 bytes long.
Data: <(i z > 28 69 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{270} normal block at 0x000002097A816500, 16 bytes long.
Data: < i z > 00 69 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{269} normal block at 0x000002097A8164B0, 16 bytes long.
Data: <Øh z > D8 68 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{268} normal block at 0x000002097A815AB0, 16 bytes long.
Data: <°h z > B0 68 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x000002097A8160F0, 16 bytes long.
Data: <PM z > 50 4D 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{265} normal block at 0x000002097A814D50, 40 bytes long.
Data: <ð` z °RC| > F0 60 81 7A 09 02 00 00 B0 52 43 7C 09 02 00 00
{264} normal block at 0x000002097A816640, 16 bytes long.
Data: < h z > 90 68 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{263} normal block at 0x000002097A815FB0, 16 bytes long.
Data: <hh z > 68 68 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{262} normal block at 0x000002097A8119C0, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{261} normal block at 0x000002097A815A60, 16 bytes long.
Data: <@h z > 40 68 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{260} normal block at 0x000002097A816840, 992 bytes long.
Data: <`Z z À z > 60 5A 81 7A 09 02 00 00 C0 19 81 7A 09 02 00 00
{96} normal block at 0x000002097A811180, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{95} normal block at 0x000002097A80E0A0, 16 bytes long.
Data: <ðO z > F0 4F 81 7A 09 02 00 00 00 00 00 00 00 00 00 00
{94} normal block at 0x000002097A814FF0, 40 bytes long.
Data: < à z z > A0 E0 80 7A 09 02 00 00 80 11 81 7A 09 02 00 00
{73} normal block at 0x000002097A80D470, 16 bytes long.
Data: < êéZ÷ > 80 EA E9 5A F7 7F 00 00 00 00 00 00 00 00 00 00
{72} normal block at 0x000002097A80DC40, 16 bytes long.
Data: <@ééZ÷ > 40 E9 E9 5A F7 7F 00 00 00 00 00 00 00 00 00 00
{71} normal block at 0x000002097A80DE70, 16 bytes long.
Data: <øWæZ÷ > F8 57 E6 5A F7 7F 00 00 00 00 00 00 00 00 00 00
{70} normal block at 0x000002097A80D600, 16 bytes long.
Data: <ØWæZ÷ > D8 57 E6 5A F7 7F 00 00 00 00 00 00 00 00 00 00
{69} normal block at 0x000002097A80D5B0, 16 bytes long.
Data: <P æZ÷ > 50 04 E6 5A F7 7F 00 00 00 00 00 00 00 00 00 00
{68} normal block at 0x000002097A80D920, 16 bytes long.
Data: <0 æZ÷ > 30 04 E6 5A F7 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x000002097A80DF10, 16 bytes long.
Data: <à æZ÷ > E0 02 E6 5A F7 7F 00 00 00 00 00 00 00 00 00 00
{66} normal block at 0x000002097A80E230, 16 bytes long.
Data: < æZ÷ > 10 04 E6 5A F7 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x000002097A80D560, 16 bytes long.
Data: <p æZ÷ > 70 04 E6 5A F7 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x000002097A80D830, 16 bytes long.
Data: < ÀäZ÷ > 18 C0 E4 5A F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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