Task 38580279
| Name | JNK1_A10_A05_r0_1-QUICO_ATM_GAFF2_LOMAP_JNK1_2-0-5-RND5257_0 |
| Workunit | 31545141 |
| Created | 11 Dec 2025, 14:24:42 UTC |
| Sent | 11 Dec 2025, 14:24:47 UTC |
| Report deadline | 16 Dec 2025, 14:24:47 UTC |
| Received | 12 Dec 2025, 23:19:42 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 195 (0x000000C3) EXIT_CHILD_FAILED |
| Computer ID | 637617 |
| Run time | 1 days 7 hours 52 min 5 sec |
| CPU time | 1 days 7 hours 44 min 25 sec |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 50,498.51 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 696.88 MB |
| Peak swap size | 10.04 GB |
| Peak disk usage | 3.31 GB |
Stderr output
<core_client_version>8.0.4</core_client_version>
<![CDATA[
<message>
Das Betriebssystem kann (null) nicht ausf�hren.
(0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
15:25:41 (44512): wrapper (7.9.26016): starting
15:25:41 (44512): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A10_A05_0.pdb
QB_A10_A05_0.xml
QB_A10_A05_equil.pdb
QB_A10_A05.inpcrd
QB_A10_A05_input.yaml
QB_A10_A05_mdlambda.pdb
QB_A10_A05_min.pdb
QB_A10_A05_npt.pdb
QB_A10_A05_out_merged_nowater.pdb
QB_A10_A05.pdb
QB_A10_A05.prmtop
QB_A10_A05_sys.xml
QB_A10_A05_therm.pdb
run.bat
run.sh
15:25:42 (44512): Library/usr/bin/tar.exe exited; CPU time 0.000000
15:25:42 (44512): 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 'X:\BOINC_Data\02_9002\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 X:\BOINC_Data\02_9002\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
Using cached 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)
Using cached 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 X:\BOINC_Data\02_9002\slots\0\pip-build-env-290w5q86\overlay\Scripts
Successfully installed packaging-25.0 setuptools-80.9.0 setuptools-scm-9.2.2
Running command Getting requirements to build wheel
X:\BOINC_Data\02_9002\slots\0\pip-build-env-290w5q86\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)
X:\BOINC_Data\02_9002\slots\0\pip-build-env-290w5q86\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 X:\BOINC_Data\02_9002\slots\0\pip-modern-metadata-e89b_5xa\atom_openmm.egg-info
writing X:\BOINC_Data\02_9002\slots\0\pip-modern-metadata-e89b_5xa\atom_openmm.egg-info\PKG-INFO
writing dependency_links to X:\BOINC_Data\02_9002\slots\0\pip-modern-metadata-e89b_5xa\atom_openmm.egg-info\dependency_links.txt
writing entry points to X:\BOINC_Data\02_9002\slots\0\pip-modern-metadata-e89b_5xa\atom_openmm.egg-info\entry_points.txt
writing requirements to X:\BOINC_Data\02_9002\slots\0\pip-modern-metadata-e89b_5xa\atom_openmm.egg-info\requires.txt
writing top-level names to X:\BOINC_Data\02_9002\slots\0\pip-modern-metadata-e89b_5xa\atom_openmm.egg-info\top_level.txt
writing manifest file 'X:\BOINC_Data\02_9002\slots\0\pip-modern-metadata-e89b_5xa\atom_openmm.egg-info\SOURCES.txt'
listing git files failed - pretending there aren't any
reading manifest file 'X:\BOINC_Data\02_9002\slots\0\pip-modern-metadata-e89b_5xa\atom_openmm.egg-info\SOURCES.txt'
reading manifest template 'MANIFEST.in'
adding license file 'LICENSE'
writing manifest file 'X:\BOINC_Data\02_9002\slots\0\pip-modern-metadata-e89b_5xa\atom_openmm.egg-info\SOURCES.txt'
creating 'X:\BOINC_Data\02_9002\slots\0\pip-modern-metadata-e89b_5xa\atom_openmm-8.4.0.dist-info'
Running command Building wheel for atom-openmm (pyproject.toml)
X:\BOINC_Data\02_9002\slots\0\pip-build-env-290w5q86\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 'X:\BOINC_Data\02_9002\slots\0\pip-wheel-2fd9fuzl\.tmp-gtynxkaw\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 'X:\BOINC_Data\02_9002\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) : {3835549} normal block at 0x0000026A48A3D200, 8 bytes long.
Data: < MJj > 00 00 4D 4A 6A 02 00 00
..\lib\diagnostics_win.cpp(417) : {3833952} normal block at 0x0000026A4A954780, 1080 bytes long.
Data: < > F0 9D 00 00 CD CD CD CD 84 02 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {308} normal block at 0x0000026A48A30ED0, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
18:44:40 (21100): wrapper (7.9.26016): starting
18:44:40 (21100): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
Ein Unterverzeichnis oder eine Datei mit dem Namen "X:\BOINC_Data\02_9002\slots\0\tmp" existiert bereits.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {3850232} normal block at 0x000002D06DB6D750, 8 bytes long.
Data: < m > 00 00 B4 6D D0 02 00 00
..\lib\diagnostics_win.cpp(417) : {3848635} normal block at 0x000002D06F7BEA20, 1080 bytes long.
Data: < [ D > 94 5B 00 00 CD CD CD CD 44 03 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {308} normal block at 0x000002D06DB607A0, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
22:56:55 (21204): wrapper (7.9.26016): starting
22:56:55 (21204): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
Ein Unterverzeichnis oder eine Datei mit dem Namen "X:\BOINC_Data\02_9002\slots\0\tmp" existiert bereits.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {3850232} normal block at 0x000001C778D9E000, 8 bytes long.
Data: < x > 00 00 D6 78 C7 01 00 00
..\lib\diagnostics_win.cpp(417) : {3848635} normal block at 0x000001C778E7E910, 1080 bytes long.
Data: < > B0 1E 00 00 CD CD CD CD A8 02 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {308} normal block at 0x000001C778D91680, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
17:14:51 (20892): wrapper (7.9.26016): starting
17:14:51 (20892): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
Ein Unterverzeichnis oder eine Datei mit dem Namen "X:\BOINC_Data\02_9002\slots\0\tmp" existiert bereits.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {3850232} normal block at 0x00000238869CCE60, 8 bytes long.
Data: < 8 > 00 00 99 86 38 02 00 00
..\lib\diagnostics_win.cpp(417) : {3848635} normal block at 0x00000238887A2C00, 1080 bytes long.
Data: <$. > 24 2E 00 00 CD CD CD CD A4 02 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {308} normal block at 0x00000238869C1C40, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
20:39:29 (21548): wrapper (7.9.26016): starting
20:39:29 (21548): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
Ein Unterverzeichnis oder eine Datei mit dem Namen "X:\BOINC_Data\02_9002\slots\0\tmp" existiert bereits.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {3850232} normal block at 0x000001B2820ED430, 8 bytes long.
Data: < > 00 00 0B 82 B2 01 00 00
..\lib\diagnostics_win.cpp(417) : {3848635} normal block at 0x000001B283DE4780, 1080 bytes long.
Data: <H > 48 0E 00 00 CD CD CD CD C4 02 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {308} normal block at 0x000001B2820E0C50, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
22:00:40 (21152): wrapper (7.9.26016): starting
22:00:40 (21152): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
Ein Unterverzeichnis oder eine Datei mit dem Namen "X:\BOINC_Data\02_9002\slots\0\tmp" existiert bereits.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {3850232} normal block at 0x0000022141DBD1E0, 8 bytes long.
Data: < A! > 00 00 D6 41 21 02 00 00
..\lib\diagnostics_win.cpp(417) : {3848635} normal block at 0x0000022141DAD630, 1080 bytes long.
Data: <LR > 4C 52 00 00 CD CD CD CD EC 02 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {308} normal block at 0x0000022141DB20D0, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
00:17:44 (21200): wrapper (7.9.26016): starting
00:17:44 (21200): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
Ein Unterverzeichnis oder eine Datei mit dem Namen "X:\BOINC_Data\02_9002\slots\0\tmp" existiert bereits.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Traceback (most recent call last):
File "X:\BOINC_Data\02_9002\slots\0\Lib\site-packages\atom_openmm\openmm_async_re.py", line 432, in __init__
replica = OMMReplicaATM(i, self.basename, self.service_worker, self.logger, self.keywords)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "X:\BOINC_Data\02_9002\slots\0\Lib\site-packages\atom_openmm\ommreplica.py", line 41, in __init__
self.load_checkpoint()
File "X:\BOINC_Data\02_9002\slots\0\Lib\site-packages\atom_openmm\ommreplica.py", line 79, in load_checkpoint
self.worker.simulation.loadState(ckptfile)
File "X:\BOINC_Data\02_9002\slots\0\Lib\site-packages\openmm\app\simulation.py", line 363, in loadState
self.context.setState(mm.XmlSerializer.deserialize(xml))
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "X:\BOINC_Data\02_9002\slots\0\Lib\site-packages\openmm\openmm.py", line 19618, in deserialize
raise ValueError("Invalid input string")
ValueError: Invalid input string
During handling of the above exception, another exception occurred:
Traceback (most recent call last):
File "<frozen runpy>", line 198, in _run_module_as_main
File "<frozen runpy>", line 88, in _run_code
File "X:\BOINC_Data\02_9002\slots\0\Scripts\rbfe_production.exe\__main__.py", line 7, in <module>
File "X:\BOINC_Data\02_9002\slots\0\Lib\site-packages\atom_openmm\rbfe_production.py", line 29, in rbfe_production
rx = openmm_job_RBFE(
^^^^^^^^^^^^^^^^
File "X:\BOINC_Data\02_9002\slots\0\Lib\site-packages\atom_openmm\openmm_async_re.py", line 434, in __init__
self._exit("Error when creating replica.")
File "X:\BOINC_Data\02_9002\slots\0\Lib\site-packages\atom_openmm\async_re.py", line 69, in _exit
self.checkpointJob()
File "X:\BOINC_Data\02_9002\slots\0\Lib\site-packages\atom_openmm\openmm_async_re.py", line 48, in checkpointJob
self.update_state_of_replica(repl)
File "X:\BOINC_Data\02_9002\slots\0\Lib\site-packages\atom_openmm\openmm_async_re.py", line 86, in update_state_of_replica
stateid = self.status[repl]['stateid_current']
^^^^^^^^^^^
File "X:\BOINC_Data\02_9002\slots\0\Lib\site-packages\atom_openmm\async_re.py", line 131, in __getattribute__
return object.__getattribute__(self,name)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
AttributeError: 'openmm_job_RBFE' object has no attribute 'status'
00:18:04 (21200): C:/Windows/system32/cmd.exe exited; CPU time 8.781250
00:18:04 (21200): app exit status: 0x16
00:18:04 (21200): called boinc_finish(195)
0 bytes in 0 Free Blocks.
646 bytes in 8 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: 285249 bytes.
Dumping objects ->
{3850321} normal block at 0x000001DA97B5D500, 48 bytes long.
Data: <PATH=X:\BOINC_DA> 50 41 54 48 3D 58 3A 5C 42 4F 49 4E 43 5F 44 41
{3850310} normal block at 0x000001DA97B5D5E0, 48 bytes long.
Data: <HOME=X:\BOINC_DA> 48 4F 4D 45 3D 58 3A 5C 42 4F 49 4E 43 5F 44 41
{3850299} normal block at 0x000001DA95DE4AB0, 48 bytes long.
Data: <TMP=X:\BOINC_DAT> 54 4D 50 3D 58 3A 5C 42 4F 49 4E 43 5F 44 41 54
{3850288} normal block at 0x000001DA95DE4960, 48 bytes long.
Data: <TEMP=X:\BOINC_DA> 54 45 4D 50 3D 58 3A 5C 42 4F 49 4E 43 5F 44 41
{3850277} normal block at 0x000001DA95DE4810, 48 bytes long.
Data: <TMPDIR=X:\BOINC_> 54 4D 50 44 49 52 3D 58 3A 5C 42 4F 49 4E 43 5F
{3850246} normal block at 0x000001DA97BA5180, 64 bytes long.
Data: <PATH=X:\BOINC_DA> 50 41 54 48 3D 58 3A 5C 42 4F 49 4E 43 5F 44 41
{3850235} normal block at 0x000001DA95E50D10, 195 bytes long.
Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65
..\api\boinc_api.cpp(309) : {3850232} normal block at 0x000001DA95DDD3A0, 8 bytes long.
Data: < Ù•Ú > 00 00 D9 95 DA 01 00 00
{3849411} normal block at 0x000001DA95E52810, 195 bytes long.
Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65
{3848636} normal block at 0x000001DA95DDD6C0, 8 bytes long.
Data: < IÀ—Ú > 90 49 C0 97 DA 01 00 00
..\zip\boinc_zip.cpp(122) : {308} normal block at 0x000001DA95DD1150, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{293} normal block at 0x000001DA95DD1B50, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
{292} normal block at 0x000001DA95DE6370, 16 bytes long.
Data: < gÞ•Ú > 08 67 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{291} normal block at 0x000001DA95DE62D0, 16 bytes long.
Data: <àfÞ•Ú > E0 66 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{290} normal block at 0x000001DA95DE12B0, 32 bytes long.
Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D
{289} normal block at 0x000001DA95DE61E0, 16 bytes long.
Data: <¸fÞ•Ú > B8 66 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{288} normal block at 0x000001DA95DE5510, 16 bytes long.
Data: < fÞ•Ú > 90 66 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x000001DA95DE6230, 16 bytes long.
Data: <hfÞ•Ú > 68 66 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{286} normal block at 0x000001DA95DE6190, 16 bytes long.
Data: <@fÞ•Ú > 40 66 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{285} normal block at 0x000001DA95DE4D50, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{284} normal block at 0x000001DA95DE6140, 16 bytes long.
Data: <¸ Þ•Ú > B8 07 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{283} normal block at 0x000001DA95DE1250, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{282} normal block at 0x000001DA95DE5C40, 16 bytes long.
Data: < Þ•Ú > 90 07 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x000001DA95DE5DD0, 16 bytes long.
Data: <h Þ•Ú > 68 07 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x000001DA95DE5740, 16 bytes long.
Data: <@ Þ•Ú > 40 07 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{278} normal block at 0x000001DA95DE6320, 16 bytes long.
Data: < Þ•Ú > 18 07 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x000001DA95DE6050, 16 bytes long.
Data: <ð Þ•Ú > F0 06 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{276} normal block at 0x000001DA95DE56F0, 16 bytes long.
Data: <È Þ•Ú > C8 06 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x000001DA95DE1490, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{274} normal block at 0x000001DA95DE5C90, 16 bytes long.
Data: <  Þ•Ú > A0 06 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{273} normal block at 0x000001DA95DE06A0, 320 bytes long.
Data: < \Þ•Ú Þ•Ú > 90 5C DE 95 DA 01 00 00 90 14 DE 95 DA 01 00 00
{272} normal block at 0x000001DA95DE5F60, 16 bytes long.
Data: < fÞ•Ú > 20 66 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{271} normal block at 0x000001DA95DE5880, 16 bytes long.
Data: <øeÞ•Ú > F8 65 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{270} normal block at 0x000001DA95DE0F50, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{269} normal block at 0x000001DA95DE6280, 16 bytes long.
Data: <ÐeÞ•Ú > D0 65 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{268} normal block at 0x000001DA95DE0B90, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{267} normal block at 0x000001DA95DE57E0, 16 bytes long.
Data: < eÞ•Ú > 18 65 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x000001DA95DE54C0, 16 bytes long.
Data: <ðdÞ•Ú > F0 64 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{265} normal block at 0x000001DA95DE5830, 16 bytes long.
Data: <ÈdÞ•Ú > C8 64 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{264} normal block at 0x000001DA95DE5D30, 16 bytes long.
Data: < dÞ•Ú > A0 64 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{263} normal block at 0x000001DA95DE5A10, 16 bytes long.
Data: <xdÞ•Ú > 78 64 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{262} normal block at 0x000001DA95DE5F10, 16 bytes long.
Data: <PdÞ•Ú > 50 64 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{260} normal block at 0x000001DA95DE5B50, 16 bytes long.
Data: < LÞ•Ú > 00 4C DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{259} normal block at 0x000001DA95DE4C00, 40 bytes long.
Data: <P[Þ•Ú Qº—Ú > 50 5B DE 95 DA 01 00 00 80 51 BA 97 DA 01 00 00
{258} normal block at 0x000001DA95DE6000, 16 bytes long.
Data: <0dÞ•Ú > 30 64 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{257} normal block at 0x000001DA95DE5CE0, 16 bytes long.
Data: < dÞ•Ú > 08 64 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{256} normal block at 0x000001DA95DE0D70, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{255} normal block at 0x000001DA95DE60F0, 16 bytes long.
Data: <àcÞ•Ú > E0 63 DE 95 DA 01 00 00 00 00 00 00 00 00 00 00
{254} normal block at 0x000001DA95DE63E0, 992 bytes long.
Data: <ð`Þ•Ú p Þ•Ú > F0 60 DE 95 DA 01 00 00 70 0D DE 95 DA 01 00 00
{90} normal block at 0x000001DA95DE1610, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{89} normal block at 0x000001DA95DDD670, 16 bytes long.
Data: < Ý•Ú > 00 02 DD 95 DA 01 00 00 00 00 00 00 00 00 00 00
{88} normal block at 0x000001DA95DD0200, 40 bytes long.
Data: <pÖÝ•Ú Þ•Ú > 70 D6 DD 95 DA 01 00 00 10 16 DE 95 DA 01 00 00
{67} normal block at 0x000001DA95DDDC60, 16 bytes long.
Data: < ê –ö > 80 EA 1F 96 F6 7F 00 00 00 00 00 00 00 00 00 00
{66} normal block at 0x000001DA95DDDC10, 16 bytes long.
Data: <@é –ö > 40 E9 1F 96 F6 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x000001DA95DDD170, 16 bytes long.
Data: <øW –ö > F8 57 1C 96 F6 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x000001DA95DDCFE0, 16 bytes long.
Data: <ØW –ö > D8 57 1C 96 F6 7F 00 00 00 00 00 00 00 00 00 00
{63} normal block at 0x000001DA95DDDBC0, 16 bytes long.
Data: <P –ö > 50 04 1C 96 F6 7F 00 00 00 00 00 00 00 00 00 00
{62} normal block at 0x000001DA95DDD120, 16 bytes long.
Data: <0 –ö > 30 04 1C 96 F6 7F 00 00 00 00 00 00 00 00 00 00
{61} normal block at 0x000001DA95DDDA30, 16 bytes long.
Data: <à –ö > E0 02 1C 96 F6 7F 00 00 00 00 00 00 00 00 00 00
{60} normal block at 0x000001DA95DDD490, 16 bytes long.
Data: < –ö > 10 04 1C 96 F6 7F 00 00 00 00 00 00 00 00 00 00
{59} normal block at 0x000001DA95DDDB70, 16 bytes long.
Data: <p –ö > 70 04 1C 96 F6 7F 00 00 00 00 00 00 00 00 00 00
{58} normal block at 0x000001DA95DDD7B0, 16 bytes long.
Data: < À –ö > 18 C0 1A 96 F6 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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