| Name | test_374-GPUGRID_TEST_ATM_40STEP_20261023-22-40-RND6800_0 |
| Workunit | 31620507 |
| Created | 26 Oct 2026, 18:13:52 UTC |
| Sent | 26 Oct 2026, 18:13:53 UTC |
| Report deadline | 31 Oct 2026, 18:13:53 UTC |
| Received | 26 Oct 2026, 19:26:33 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 195 (0x000000C3) EXIT_CHILD_FAILED |
| Computer ID | 592657 |
| Run time | 15 min 26 sec |
| CPU time | 15 min 26 sec |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 35,585.07 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 686.85 MB |
| Peak swap size | 9.97 GB |
| Peak disk usage | 3.03 GB |
<core_client_version>8.2.11</core_client_version>
<![CDATA[
<message>
The operating system cannot run (null).
(0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
14:55:12 (38924): wrapper (7.9.26016): starting
14:55:12 (38924): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A34_A12_0.pdb
QB_A34_A12_0.xml
QB_A34_A12_input.yaml
QB_A34_A12.pdb
QB_A34_A12.prmtop
QB_A34_A12_sys.xml
run.bat
run.sh
14:55:13 (38924): Library/usr/bin/tar.exe exited; CPU time 0.015625
14:55:13 (38924): 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\1\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: 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\1\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) : {3835165} normal block at 0x000001E02743CF80, 8 bytes long.
Data: < =' > 00 00 3D 27 E0 01 00 00
..\lib\diagnostics_win.cpp(417) : {3833994} normal block at 0x000001E0291DA640, 1080 bytes long.
Data: < x > B0 EA 00 00 CD CD CD CD 78 02 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {329} normal block at 0x000001E027437D00, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
15:10:42 (8408): wrapper (7.9.26016): starting
15:10:42 (8408): 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\1\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1493} normal block at 0x000002A477E16ED0, 8 bytes long.
Data: < y > 00 00 94 79 A4 02 00 00
..\lib\diagnostics_win.cpp(417) : {322} normal block at 0x000002A477E15A60, 1080 bytes long.
Data: <x T > 78 D1 00 00 CD CD CD CD 54 01 00 00 00 00 00 00
Object dump complete.
15:14:20 (17592): wrapper (7.9.26016): starting
15:14:20 (17592): 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\1\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1493} normal block at 0x00000256515A77C0, 8 bytes long.
Data: < QV > 00 00 AA 51 56 02 00 00
..\lib\diagnostics_win.cpp(417) : {322} normal block at 0x00000256515A6990, 1080 bytes long.
Data: < > 00 A1 00 00 CD CD CD CD C0 00 00 00 00 00 00 00
Object dump complete.
15:24:25 (59684): wrapper (7.9.26016): starting
15:24:25 (59684): 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\1\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Traceback (most recent call last):
File "C:\ProgramData\BOINC\slots\1\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 "C:\ProgramData\BOINC\slots\1\Lib\site-packages\atom_openmm\ommreplica.py", line 41, in __init__
self.load_checkpoint()
File "C:\ProgramData\BOINC\slots\1\Lib\site-packages\atom_openmm\ommreplica.py", line 79, in load_checkpoint
self.worker.simulation.loadState(ckptfile)
File "C:\ProgramData\BOINC\slots\1\Lib\site-packages\openmm\app\simulation.py", line 363, in loadState
self.context.setState(mm.XmlSerializer.deserialize(xml))
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\ProgramData\BOINC\slots\1\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 "C:\ProgramData\BOINC\slots\1\Scripts\rbfe_production.exe\__main__.py", line 7, in <module>
File "C:\ProgramData\BOINC\slots\1\Lib\site-packages\atom_openmm\rbfe_production.py", line 29, in rbfe_production
rx = openmm_job_RBFE(
^^^^^^^^^^^^^^^^
File "C:\ProgramData\BOINC\slots\1\Lib\site-packages\atom_openmm\openmm_async_re.py", line 434, in __init__
self._exit("Error when creating replica.")
File "C:\ProgramData\BOINC\slots\1\Lib\site-packages\atom_openmm\async_re.py", line 69, in _exit
self.checkpointJob()
File "C:\ProgramData\BOINC\slots\1\Lib\site-packages\atom_openmm\openmm_async_re.py", line 48, in checkpointJob
self.update_state_of_replica(repl)
File "C:\ProgramData\BOINC\slots\1\Lib\site-packages\atom_openmm\openmm_async_re.py", line 86, in update_state_of_replica
stateid = self.status[repl]['stateid_current']
^^^^^^^^^^^
File "C:\ProgramData\BOINC\slots\1\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'
15:24:48 (59684): C:/Windows/system32/cmd.exe exited; CPU time 19.453125
15:24:48 (59684): app exit status: 0x16
15:24:48 (59684): called boinc_finish(195)
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: 772230 bytes.
Dumping objects ->
{1581} normal block at 0x0000025B4E7CFD20, 48 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{1570} normal block at 0x0000025B4E7CFFC0, 48 bytes long.
Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{1559} normal block at 0x0000025B4E7CFF50, 48 bytes long.
Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61
{1548} normal block at 0x0000025B4E7CFA10, 48 bytes long.
Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{1537} normal block at 0x0000025B4E7CFB60, 48 bytes long.
Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61
{1506} normal block at 0x0000025B4E7C1210, 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) : {1493} normal block at 0x0000025B4E7D5740, 8 bytes long.
Data: < xN[ > 00 00 78 4E 5B 02 00 00
{323} normal block at 0x0000025B4E7D5420, 8 bytes long.
Data: < M}N[ > 20 4D 7D 4E 5B 02 00 00
{314} normal block at 0x0000025B4E7C8D20, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
{313} normal block at 0x0000025B4E7D5CE0, 16 bytes long.
Data: <hf}N[ > 68 66 7D 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{312} normal block at 0x0000025B4E7D56F0, 16 bytes long.
Data: <@f}N[ > 40 66 7D 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{311} normal block at 0x0000025B4E7CF7B0, 32 bytes long.
Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D
{310} normal block at 0x0000025B4E7D56A0, 16 bytes long.
Data: < f}N[ > 18 66 7D 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{309} normal block at 0x0000025B4E7D54C0, 16 bytes long.
Data: < e}N[ > F0 65 7D 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{308} normal block at 0x0000025B4E7D60A0, 16 bytes long.
Data: < e}N[ > C8 65 7D 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{307} normal block at 0x0000025B4E7D62D0, 16 bytes long.
Data: < e}N[ > A0 65 7D 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{306} normal block at 0x0000025B4E7CF9A0, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{305} normal block at 0x0000025B4E7D5E70, 16 bytes long.
Data: < {N[ > 98 D9 7B 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{304} normal block at 0x0000025B4E7CEDF0, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{303} normal block at 0x0000025B4E7D5C40, 16 bytes long.
Data: <p {N[ > 70 D9 7B 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{301} normal block at 0x0000025B4E7D5AB0, 16 bytes long.
Data: <H {N[ > 48 D9 7B 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{300} normal block at 0x0000025B4E7D5650, 16 bytes long.
Data: < {N[ > 20 D9 7B 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{299} normal block at 0x0000025B4E7D5BF0, 16 bytes long.
Data: < {N[ > F8 D8 7B 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{298} normal block at 0x0000025B4E7D5600, 16 bytes long.
Data: < {N[ > D0 D8 7B 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{297} normal block at 0x0000025B4E7D5F10, 16 bytes long.
Data: < {N[ > A8 D8 7B 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{296} normal block at 0x0000025B4E7CE970, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{295} normal block at 0x0000025B4E7D5A60, 16 bytes long.
Data: < {N[ > 80 D8 7B 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{294} normal block at 0x0000025B4E7BD880, 320 bytes long.
Data: <`Z}N[ p |N[ > 60 5A 7D 4E 5B 02 00 00 70 E9 7C 4E 5B 02 00 00
{293} normal block at 0x0000025B4E7D5970, 16 bytes long.
Data: < e}N[ > 80 65 7D 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x0000025B4E7D5DD0, 16 bytes long.
Data: <Xe}N[ > 58 65 7D 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{291} normal block at 0x0000025B4E7CF0F0, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{290} normal block at 0x0000025B4E7D5F60, 16 bytes long.
Data: <0e}N[ > 30 65 7D 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x0000025B4E7CF090, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{288} normal block at 0x0000025B4E7D5C90, 16 bytes long.
Data: <xd}N[ > 78 64 7D 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x0000025B4E7D58D0, 16 bytes long.
Data: <Pd}N[ > 50 64 7D 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{286} normal block at 0x0000025B4E7D6000, 16 bytes long.
Data: <(d}N[ > 28 64 7D 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{285} normal block at 0x0000025B4E7D59C0, 16 bytes long.
Data: < d}N[ > 00 64 7D 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{284} normal block at 0x0000025B4E7D5A10, 16 bytes long.
Data: < c}N[ > D8 63 7D 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{283} normal block at 0x0000025B4E7D61E0, 16 bytes long.
Data: < c}N[ > B0 63 7D 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x0000025B4E7D5E20, 16 bytes long.
Data: < |N[ > B0 FC 7C 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x0000025B4E7CFCB0, 40 bytes long.
Data: < ^}N[ |N[ > 20 5E 7D 4E 5B 02 00 00 10 12 7C 4E 5B 02 00 00
{279} normal block at 0x0000025B4E7D5880, 16 bytes long.
Data: < c}N[ > 90 63 7D 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{278} normal block at 0x0000025B4E7D5560, 16 bytes long.
Data: <hc}N[ > 68 63 7D 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x0000025B4E7CF450, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{276} normal block at 0x0000025B4E7D5BA0, 16 bytes long.
Data: <@c}N[ > 40 63 7D 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x0000025B4E7D6340, 992 bytes long.
Data: < [}N[ P |N[ > A0 5B 7D 4E 5B 02 00 00 50 F4 7C 4E 5B 02 00 00
{111} normal block at 0x0000025B4E7CEA30, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{110} normal block at 0x0000025B4E7CCEE0, 16 bytes long.
Data: <0 |N[ > 30 F9 7C 4E 5B 02 00 00 00 00 00 00 00 00 00 00
{109} normal block at 0x0000025B4E7CF930, 40 bytes long.
Data: < |N[ 0 |N[ > E0 CE 7C 4E 5B 02 00 00 30 EA 7C 4E 5B 02 00 00
{88} normal block at 0x0000025B4E7CD390, 16 bytes long.
Data: < r" > 80 EA 72 22 F7 7F 00 00 00 00 00 00 00 00 00 00
{87} normal block at 0x0000025B4E7CCE90, 16 bytes long.
Data: <@ r" > 40 E9 72 22 F7 7F 00 00 00 00 00 00 00 00 00 00
{86} normal block at 0x0000025B4E7CCD50, 16 bytes long.
Data: < Wo" > F8 57 6F 22 F7 7F 00 00 00 00 00 00 00 00 00 00
{85} normal block at 0x0000025B4E7CCB70, 16 bytes long.
Data: < Wo" > D8 57 6F 22 F7 7F 00 00 00 00 00 00 00 00 00 00
{84} normal block at 0x0000025B4E7CCD00, 16 bytes long.
Data: <P o" > 50 04 6F 22 F7 7F 00 00 00 00 00 00 00 00 00 00
{83} normal block at 0x0000025B4E7CD520, 16 bytes long.
Data: <0 o" > 30 04 6F 22 F7 7F 00 00 00 00 00 00 00 00 00 00
{82} normal block at 0x0000025B4E7CCCB0, 16 bytes long.
Data: < o" > E0 02 6F 22 F7 7F 00 00 00 00 00 00 00 00 00 00
{81} normal block at 0x0000025B4E7CC9E0, 16 bytes long.
Data: < o" > 10 04 6F 22 F7 7F 00 00 00 00 00 00 00 00 00 00
{80} normal block at 0x0000025B4E7CCC60, 16 bytes long.
Data: <p o" > 70 04 6F 22 F7 7F 00 00 00 00 00 00 00 00 00 00
{79} normal block at 0x0000025B4E7CCF30, 16 bytes long.
Data: < m" > 18 C0 6D 22 F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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