Task 38583660
| Name | PFKFB3_A18_A36_r0_3-QUICO_ATM_GAFF2_LOMAP_PFKFB3-3-5-RND0190_0 |
| Workunit | 31547738 |
| Created | 14 Dec 2025, 12:27:25 UTC |
| Sent | 14 Dec 2025, 12:27:30 UTC |
| Report deadline | 19 Dec 2025, 12:27:30 UTC |
| Received | 18 Dec 2025, 1:59:05 UTC |
| Server state | Over |
| Outcome | Success |
| Client state | Done |
| Exit status | 0 (0x00000000) |
| Computer ID | 640733 |
| Run time | 9 hours 58 min 1 sec |
| CPU time | 9 hours 53 min 14 sec |
| Validate state | Valid |
| Credit | 750,000.00 |
| Device peak FLOPS | 12,747.67 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 779.45 MB |
| Peak swap size | 5.48 GB |
| Peak disk usage | 3.70 GB |
Stderr output
<core_client_version>8.2.8</core_client_version>
<![CDATA[
<stderr_txt>
08:37:02 (11580): wrapper (7.9.26016): starting
08:37:02 (11580): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A18_A36_0.pdb
QB_A18_A36_0.xml
QB_A18_A36_equil.pdb
QB_A18_A36.inpcrd
QB_A18_A36_input.yaml
QB_A18_A36_mdlambda.pdb
QB_A18_A36_min.pdb
QB_A18_A36_npt.pdb
QB_A18_A36.pdb
QB_A18_A36.prmtop
QB_A18_A36_sys.xml
QB_A18_A36_therm.pdb
run.bat
run.sh
08:37:04 (11580): Library/usr/bin/tar.exe exited; CPU time 0.000000
08:37:04 (11580): 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\4\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\4\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\4\pip-build-env-_qsnojvl\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\4\pip-build-env-_qsnojvl\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\4\pip-build-env-_qsnojvl\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\4\pip-modern-metadata-nxb92kh4\atom_openmm.egg-info
writing C:\ProgramData\BOINC\slots\4\pip-modern-metadata-nxb92kh4\atom_openmm.egg-info\PKG-INFO
writing dependency_links to C:\ProgramData\BOINC\slots\4\pip-modern-metadata-nxb92kh4\atom_openmm.egg-info\dependency_links.txt
writing entry points to C:\ProgramData\BOINC\slots\4\pip-modern-metadata-nxb92kh4\atom_openmm.egg-info\entry_points.txt
writing requirements to C:\ProgramData\BOINC\slots\4\pip-modern-metadata-nxb92kh4\atom_openmm.egg-info\requires.txt
writing top-level names to C:\ProgramData\BOINC\slots\4\pip-modern-metadata-nxb92kh4\atom_openmm.egg-info\top_level.txt
writing manifest file 'C:\ProgramData\BOINC\slots\4\pip-modern-metadata-nxb92kh4\atom_openmm.egg-info\SOURCES.txt'
listing git files failed - pretending there aren't any
reading manifest file 'C:\ProgramData\BOINC\slots\4\pip-modern-metadata-nxb92kh4\atom_openmm.egg-info\SOURCES.txt'
reading manifest template 'MANIFEST.in'
adding license file 'LICENSE'
writing manifest file 'C:\ProgramData\BOINC\slots\4\pip-modern-metadata-nxb92kh4\atom_openmm.egg-info\SOURCES.txt'
creating 'C:\ProgramData\BOINC\slots\4\pip-modern-metadata-nxb92kh4\atom_openmm-8.4.0.dist-info'
Running command Building wheel for atom-openmm (pyproject.toml)
C:\ProgramData\BOINC\slots\4\pip-build-env-_qsnojvl\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\4\pip-wheel-z82sc_5i\.tmp-olwxz59f\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\4\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) : {3836013} normal block at 0x0000017AD7EB4AA0, 8 bytes long.
Data: < 4 z > 00 00 34 D8 7A 01 00 00
..\lib\diagnostics_win.cpp(417) : {3834076} normal block at 0x0000017ADB73DCA0, 1080 bytes long.
Data: < > A8 0E 00 00 CD CD CD CD D4 02 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {317} normal block at 0x0000017AD7EA6260, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
08:50:06 (20716): wrapper (7.9.26016): starting
08:50:06 (20716): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {2247} normal block at 0x000002356D7CD310, 8 bytes long.
Data: < m5 > 00 00 D6 6D 35 02 00 00
..\lib\diagnostics_win.cpp(417) : {310} normal block at 0x000002356D7CDBA0, 1080 bytes long.
Data: < ' > E0 27 00 00 CD CD CD CD D0 01 00 00 00 00 00 00
Object dump complete.
09:13:31 (4580): wrapper (7.9.26016): starting
09:13:31 (4580): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {2247} normal block at 0x0000018D4108C4F0, 8 bytes long.
Data: < B > 00 00 BA 42 8D 01 00 00
..\lib\diagnostics_win.cpp(417) : {310} normal block at 0x0000018D4108C9C0, 1080 bytes long.
Data: < " > BC 22 00 00 CD CD CD CD D0 01 00 00 00 00 00 00
Object dump complete.
20:58:37 (4216): wrapper (7.9.26016): starting
20:58:37 (4216): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {2247} normal block at 0x0000021B23EEBDA0, 8 bytes long.
Data: < Z' > 00 00 5A 27 1B 02 00 00
..\lib\diagnostics_win.cpp(417) : {310} normal block at 0x0000021B23EEC950, 1080 bytes long.
Data: < + > B4 2B 00 00 CD CD CD CD D0 01 00 00 00 00 00 00
Object dump complete.
21:29:20 (4320): wrapper (7.9.26016): starting
21:29:20 (4320): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {2247} normal block at 0x000002D23EBEC940, 8 bytes long.
Data: < 1B > 00 00 31 42 D2 02 00 00
..\lib\diagnostics_win.cpp(417) : {310} normal block at 0x000002D23EBEC9B0, 1080 bytes long.
Data: < # > 18 23 00 00 CD CD CD CD B0 01 00 00 00 00 00 00
Object dump complete.
12:03:37 (19236): wrapper (7.9.26016): starting
12:03:37 (19236): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {2247} normal block at 0x0000022EEF6FBAC0, 8 bytes long.
Data: < # . > 00 00 23 F1 2E 02 00 00
..\lib\diagnostics_win.cpp(417) : {310} normal block at 0x0000022EEF6FBC70, 1080 bytes long.
Data: < @ > D8 40 00 00 CD CD CD CD B8 00 00 00 00 00 00 00
Object dump complete.
12:45:01 (3812): wrapper (7.9.26016): starting
12:45:01 (3812): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {2247} normal block at 0x0000029AF12AC0F0, 8 bytes long.
Data: < p > 00 00 70 F1 9A 02 00 00
..\lib\diagnostics_win.cpp(417) : {310} normal block at 0x0000029AF12AC390, 1080 bytes long.
Data: < ( > B4 28 00 00 CD CD CD CD D0 01 00 00 00 00 00 00
Object dump complete.
15:07:30 (21316): wrapper (7.9.26016): starting
15:07:30 (21316): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {2247} normal block at 0x00000299DE53C060, 8 bytes long.
Data: < > 00 00 0E E0 99 02 00 00
..\lib\diagnostics_win.cpp(417) : {310} normal block at 0x00000299DE53C530, 1080 bytes long.
Data: < + > A0 2B 00 00 CD CD CD CD 8C 01 00 00 00 00 00 00
Object dump complete.
15:12:37 (5824): wrapper (7.9.26016): starting
15:12:37 (5824): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {2247} normal block at 0x000002249145BAE0, 8 bytes long.
Data: < $ > 00 00 F5 92 24 02 00 00
..\lib\diagnostics_win.cpp(417) : {310} normal block at 0x000002249145C9B0, 1080 bytes long.
Data: <| > 7C 13 00 00 CD CD CD CD D0 01 00 00 00 00 00 00
Object dump complete.
15:23:19 (19828): wrapper (7.9.26016): starting
15:23:19 (19828): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {2247} normal block at 0x000001EF685EC3D0, 8 bytes long.
Data: < h > 00 00 A6 68 EF 01 00 00
..\lib\diagnostics_win.cpp(417) : {310} normal block at 0x000001EF685EC940, 1080 bytes long.
Data: < > 84 16 00 00 CD CD CD CD B0 01 00 00 00 00 00 00
Object dump complete.
20:58:42 (16800): wrapper (7.9.26016): starting
20:58:42 (16800): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {2247} normal block at 0x0000020D6DE5B090, 8 bytes long.
Data: < o > 00 00 82 6F 0D 02 00 00
..\lib\diagnostics_win.cpp(417) : {310} normal block at 0x0000020D6DE5BDD0, 1080 bytes long.
Data: <t( > 74 28 00 00 CD CD CD CD D0 01 00 00 00 00 00 00
Object dump complete.
08:17:11 (8472): wrapper (7.9.26016): starting
08:17:11 (8472): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {2247} normal block at 0x0000025818CEBFE0, 8 bytes long.
Data: < X > 00 00 88 1A 58 02 00 00
..\lib\diagnostics_win.cpp(417) : {310} normal block at 0x0000025818CEC9B0, 1080 bytes long.
Data: <$! > 24 21 00 00 CD CD CD CD D0 01 00 00 00 00 00 00
Object dump complete.
08:26:17 (19420): wrapper (7.9.26016): starting
08:26:17 (19420): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {2247} normal block at 0x000002972176C570, 8 bytes long.
Data: < ! > 00 00 C4 21 97 02 00 00
..\lib\diagnostics_win.cpp(417) : {310} normal block at 0x000002972176C720, 1080 bytes long.
Data: <t > 74 04 00 00 CD CD CD CD D8 01 00 00 00 00 00 00
Object dump complete.
08:29:44 (16256): wrapper (7.9.26016): starting
08:29:44 (16256): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {2247} normal block at 0x000002652EA1B330, 8 bytes long.
Data: < 2e > 00 00 0B 32 65 02 00 00
..\lib\diagnostics_win.cpp(417) : {310} normal block at 0x000002652EA1BB20, 1080 bytes long.
Data: < C > F0 43 00 00 CD CD CD CD B0 01 00 00 00 00 00 00
Object dump complete.
08:55:01 (14384): wrapper (7.9.26016): starting
08:55:01 (14384): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {2247} normal block at 0x0000019F4EEAC850, 8 bytes long.
Data: < P > 00 00 98 50 9F 01 00 00
..\lib\diagnostics_win.cpp(417) : {310} normal block at 0x0000019F4EEAC9B0, 1080 bytes long.
Data: < > D4 1E 00 00 CD CD CD CD D0 01 00 00 00 00 00 00
Object dump complete.
09:00:09 (9708): wrapper (7.9.26016): starting
09:00:09 (9708): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {2247} normal block at 0x000001C01378D850, 8 bytes long.
Data: < A > 00 00 41 15 C0 01 00 00
..\lib\diagnostics_win.cpp(417) : {310} normal block at 0x000001C01378DA50, 1080 bytes long.
Data: < > FC 06 00 00 CD CD CD CD D0 01 00 00 00 00 00 00
Object dump complete.
09:36:52 (6752): wrapper (7.9.26016): starting
09:36:52 (6752): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {2247} normal block at 0x00000271D59DCD10, 8 bytes long.
Data: < X q > 00 00 58 D7 71 02 00 00
..\lib\diagnostics_win.cpp(417) : {310} normal block at 0x00000271D59DDA50, 1080 bytes long.
Data: < + > 14 2B 00 00 CD CD CD CD D8 01 00 00 00 00 00 00
Object dump complete.
11:12:26 (14728): wrapper (7.9.26016): starting
11:12:26 (14728): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {2247} normal block at 0x000002615468B770, 8 bytes long.
Data: < Va > 00 00 0A 56 61 02 00 00
..\lib\diagnostics_win.cpp(417) : {310} normal block at 0x000002615468BDD0, 1080 bytes long.
Data: <L/ > 4C 2F 00 00 CD CD CD CD D0 01 00 00 00 00 00 00
Object dump complete.
21:41:21 (19400): wrapper (7.9.26016): starting
21:41:21 (19400): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {2247} normal block at 0x000002589FD1C5D0, 8 bytes long.
Data: < X > 00 00 7F A1 58 02 00 00
..\lib\diagnostics_win.cpp(417) : {310} normal block at 0x000002589FD1CA50, 1080 bytes long.
Data: < H > F4 48 00 00 CD CD CD CD D8 01 00 00 00 00 00 00
Object dump complete.
07:35:10 (13148): wrapper (7.9.26016): starting
07:35:10 (13148): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {2247} normal block at 0x000002628E51AA50, 8 bytes long.
Data: < M b > 00 00 4D 8E 62 02 00 00
..\lib\diagnostics_win.cpp(417) : {310} normal block at 0x000002628E51B420, 1080 bytes long.
Data: < # > B4 23 00 00 CD CD CD CD D0 01 00 00 00 00 00 00
Object dump complete.
07:54:29 (12920): wrapper (7.9.26016): starting
07:54:29 (12920): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ƒTƒuƒfƒBƒŒƒNƒgƒŠ‚Ü‚½‚̓tƒ@ƒCƒ‹ C:\ProgramData\BOINC\slots\4\tmp ‚ÍŠù‚É‘¶Ý‚µ‚Ü‚·B
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
10:21:04 (12920): C:/Windows/system32/cmd.exe exited; CPU time 8634.406250
10:21:04 (12920): 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: 136549864 bytes.
Dumping objects ->
{2335} normal block at 0x0000019E2D6838F0, 48 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{2324} normal block at 0x0000019E2D6839D0, 48 bytes long.
Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{2313} normal block at 0x0000019E2D683570, 48 bytes long.
Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61
{2302} normal block at 0x0000019E2D683500, 48 bytes long.
Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{2291} normal block at 0x0000019E2D683340, 48 bytes long.
Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61
{2260} normal block at 0x0000019E2D68B4D0, 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) : {2247} normal block at 0x0000019E2D68C940, 8 bytes long.
Data: < 0 > 00 00 C9 30 9E 01 00 00
{311} normal block at 0x0000019E2D68C8F0, 8 bytes long.
Data: < h- > B0 C9 68 2D 9E 01 00 00
{302} normal block at 0x0000019E2D672080, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
{301} normal block at 0x0000019E2D68BEF0, 16 bytes long.
Data: < h- > A8 B8 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{300} normal block at 0x0000019E2D68C170, 16 bytes long.
Data: < h- > 80 B8 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{299} normal block at 0x0000019E2D684EA0, 32 bytes long.
Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D
{298} normal block at 0x0000019E2D68C8A0, 16 bytes long.
Data: <X h- > 58 B8 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{297} normal block at 0x0000019E2D68BD10, 16 bytes long.
Data: <0 h- > 30 B8 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{296} normal block at 0x0000019E2D68C2B0, 16 bytes long.
Data: < h- > 08 B8 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{295} normal block at 0x0000019E2D68BDB0, 16 bytes long.
Data: < h- > E0 B7 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{294} normal block at 0x0000019E2D683810, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{293} normal block at 0x0000019E2D68C1C0, 16 bytes long.
Data: <h h- > 68 B4 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x0000019E2D684A80, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{291} normal block at 0x0000019E2D68BF90, 16 bytes long.
Data: <@ h- > 40 B4 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x0000019E2D68C800, 16 bytes long.
Data: < h- > 18 B4 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{288} normal block at 0x0000019E2D68C850, 16 bytes long.
Data: < h- > F0 B3 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x0000019E2D68C3A0, 16 bytes long.
Data: < h- > C8 B3 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{286} normal block at 0x0000019E2D68C120, 16 bytes long.
Data: < h- > A0 B3 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{285} normal block at 0x0000019E2D68BCC0, 16 bytes long.
Data: <x h- > 78 B3 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{284} normal block at 0x0000019E2D685200, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{283} normal block at 0x0000019E2D68C7B0, 16 bytes long.
Data: <P h- > 50 B3 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x0000019E2D68B350, 320 bytes long.
Data: < h- Rh- > B0 C7 68 2D 9E 01 00 00 00 52 68 2D 9E 01 00 00
{281} normal block at 0x0000019E2D68C3F0, 16 bytes long.
Data: < h- > C0 B7 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x0000019E2D68C760, 16 bytes long.
Data: < h- > 98 B7 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x0000019E2D6856E0, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{278} normal block at 0x0000019E2D68C530, 16 bytes long.
Data: <p h- > 70 B7 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x0000019E2D685620, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{276} normal block at 0x0000019E2D68C710, 16 bytes long.
Data: < h- > B8 B6 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x0000019E2D68C210, 16 bytes long.
Data: < h- > 90 B6 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{274} normal block at 0x0000019E2D6861D0, 16 bytes long.
Data: <h h- > 68 B6 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{273} normal block at 0x0000019E2D686180, 16 bytes long.
Data: <@ h- > 40 B6 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{272} normal block at 0x0000019E2D686130, 16 bytes long.
Data: < h- > 18 B6 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{271} normal block at 0x0000019E2D685C30, 16 bytes long.
Data: < h- > F0 B5 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{269} normal block at 0x0000019E2D685FA0, 16 bytes long.
Data: <07h- > 30 37 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{268} normal block at 0x0000019E2D683730, 40 bytes long.
Data: < _h- h- > A0 5F 68 2D 9E 01 00 00 D0 B4 68 2D 9E 01 00 00
{267} normal block at 0x0000019E2D685B40, 16 bytes long.
Data: < h- > D0 B5 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x0000019E2D685AA0, 16 bytes long.
Data: < h- > A8 B5 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{265} normal block at 0x0000019E2D685680, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{264} normal block at 0x0000019E2D6859B0, 16 bytes long.
Data: < h- > 80 B5 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{263} normal block at 0x0000019E2D68B580, 992 bytes long.
Data: < Yh- Vh- > B0 59 68 2D 9E 01 00 00 80 56 68 2D 9E 01 00 00
{99} normal block at 0x0000019E2D685440, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{98} normal block at 0x0000019E2D685910, 16 bytes long.
Data: < 4h- > 90 34 68 2D 9E 01 00 00 00 00 00 00 00 00 00 00
{97} normal block at 0x0000019E2D683490, 40 bytes long.
Data: < Yh- @Th- > 10 59 68 2D 9E 01 00 00 40 54 68 2D 9E 01 00 00
{74} normal block at 0x0000019E2D685CD0, 16 bytes long.
Data: < > 80 EA CB ED F6 7F 00 00 00 00 00 00 00 00 00 00
{73} normal block at 0x0000019E2D686770, 16 bytes long.
Data: <@ > 40 E9 CB ED F6 7F 00 00 00 00 00 00 00 00 00 00
{72} normal block at 0x0000019E2D685E10, 16 bytes long.
Data: < W > F8 57 C8 ED F6 7F 00 00 00 00 00 00 00 00 00 00
{71} normal block at 0x0000019E2D685B90, 16 bytes long.
Data: < W > D8 57 C8 ED F6 7F 00 00 00 00 00 00 00 00 00 00
{70} normal block at 0x0000019E2D686450, 16 bytes long.
Data: <P > 50 04 C8 ED F6 7F 00 00 00 00 00 00 00 00 00 00
{69} normal block at 0x0000019E2D686360, 16 bytes long.
Data: <0 > 30 04 C8 ED F6 7F 00 00 00 00 00 00 00 00 00 00
{68} normal block at 0x0000019E2D685A00, 16 bytes long.
Data: < > E0 02 C8 ED F6 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x0000019E2D686540, 16 bytes long.
Data: < > 10 04 C8 ED F6 7F 00 00 00 00 00 00 00 00 00 00
{66} normal block at 0x0000019E2D685EB0, 16 bytes long.
Data: <p > 70 04 C8 ED F6 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x0000019E2D6862C0, 16 bytes long.
Data: < > 18 C0 C6 ED F6 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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