| Name | test_578-GPUGRID_TEST_ATM_2STEP_20261024-0-2-RND5224_0 |
| Workunit | 31601062 |
| Created | 24 Oct 2026, 11:38:06 UTC |
| Sent | 24 Oct 2026, 11:50:25 UTC |
| Report deadline | 29 Oct 2026, 11:50:25 UTC |
| Received | 24 Oct 2026, 12:33:02 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 195 (0x000000C3) EXIT_CHILD_FAILED |
| Computer ID | 643341 |
| Run time | 5 min 23 sec |
| CPU time | 4 min 28 sec |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 30,871.08 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 721.16 MB |
| Peak swap size | 9.92 GB |
| Peak disk usage | 2.97 GB |
<core_client_version>8.2.11</core_client_version>
<![CDATA[
<message>
Das Betriebssystem kann (null) nicht ausf�hren.
(0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
13:52:05 (34088): wrapper (7.9.26016): starting
13:52:05 (34088): 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
13:52:06 (34088): Library/usr/bin/tar.exe exited; CPU time 0.000000
13:52:06 (34088): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {3835115} normal block at 0x000001E0604CC990, 8 bytes long.
Data: < C` > 00 00 43 60 E0 01 00 00
..\lib\diagnostics_win.cpp(417) : {3833960} normal block at 0x000001E062EA3500, 1080 bytes long.
Data: <xc $ > 78 63 00 00 CD CD CD CD 24 02 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {312} normal block at 0x000001E0604C5FA0, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
14:08:43 (29984): wrapper (7.9.26016): starting
14:08:43 (29984): 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 'D:\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: 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 'D:\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) : {1460} normal block at 0x000001B7F73743D0, 8 bytes long.
Data: < > 00 00 1B F7 B7 01 00 00
..\lib\diagnostics_win.cpp(417) : {305} normal block at 0x000001B7F7376280, 1080 bytes long.
Data: <0 X > 30 9C 00 00 CD CD CD CD 58 01 00 00 00 00 00 00
Object dump complete.
14:18:43 (36536): wrapper (7.9.26016): starting
14:18:43 (36536): 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 "D:\BOINC\slots\0\tmp" existiert bereits.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1460} normal block at 0x000002842AE14A10, 8 bytes long.
Data: < * > 00 00 D8 2A 84 02 00 00
..\lib\diagnostics_win.cpp(417) : {305} normal block at 0x000002842AE16280, 1080 bytes long.
Data: < X > B4 A3 00 00 CD CD CD CD 58 01 00 00 00 00 00 00
Object dump complete.
14:20:58 (1076): wrapper (7.9.26016): starting
14:20:58 (1076): 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 "D:\BOINC\slots\0\tmp" existiert bereits.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1460} normal block at 0x00000116A3844B50, 8 bytes long.
Data: < h > 00 00 68 A3 16 01 00 00
..\lib\diagnostics_win.cpp(417) : {305} normal block at 0x00000116A3846280, 1080 bytes long.
Data: <D X > 44 20 00 00 CD CD CD CD 58 01 00 00 00 00 00 00
Object dump complete.
14:22:58 (20564): wrapper (7.9.26016): starting
14:22:58 (20564): 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 "D:\BOINC\slots\0\tmp" existiert bereits.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1460} normal block at 0x0000024EF0894650, 8 bytes long.
Data: < v N > 00 00 76 F0 4E 02 00 00
..\lib\diagnostics_win.cpp(417) : {305} normal block at 0x0000024EF0896280, 1080 bytes long.
Data: < l > AC A0 00 00 CD CD CD CD 6C 01 00 00 00 00 00 00
Object dump complete.
14:25:56 (12572): wrapper (7.9.26016): starting
14:25:56 (12572): 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 "D:\BOINC\slots\0\tmp" existiert bereits.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1460} normal block at 0x000001FD305E4470, 8 bytes long.
Data: < S0 > 00 00 53 30 FD 01 00 00
..\lib\diagnostics_win.cpp(417) : {305} normal block at 0x000001FD305E6280, 1080 bytes long.
Data: <X} t > 58 7D 00 00 CD CD CD CD 74 01 00 00 00 00 00 00
Object dump complete.
14:28:20 (40396): wrapper (7.9.26016): starting
14:28:20 (40396): 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 "D:\BOINC\slots\0\tmp" existiert bereits.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1460} normal block at 0x0000016807CE48D0, 8 bytes long.
Data: < h > 00 00 AD 07 68 01 00 00
..\lib\diagnostics_win.cpp(417) : {305} normal block at 0x0000016807CE6280, 1080 bytes long.
Data: <h X > 68 A2 00 00 CD CD CD CD 58 01 00 00 00 00 00 00
Object dump complete.
14:31:44 (29340): wrapper (7.9.26016): starting
14:31:44 (29340): 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 "D:\BOINC\slots\0\tmp" existiert bereits.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Traceback (most recent call last):
File "D:\BOINC\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 "D:\BOINC\slots\0\Lib\site-packages\atom_openmm\ommreplica.py", line 41, in __init__
self.load_checkpoint()
File "D:\BOINC\slots\0\Lib\site-packages\atom_openmm\ommreplica.py", line 79, in load_checkpoint
self.worker.simulation.loadState(ckptfile)
File "D:\BOINC\slots\0\Lib\site-packages\openmm\app\simulation.py", line 363, in loadState
self.context.setState(mm.XmlSerializer.deserialize(xml))
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "D:\BOINC\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 "D:\BOINC\slots\0\Scripts\rbfe_production.exe\__main__.py", line 7, in <module>
File "D:\BOINC\slots\0\Lib\site-packages\atom_openmm\rbfe_production.py", line 29, in rbfe_production
rx = openmm_job_RBFE(
^^^^^^^^^^^^^^^^
File "D:\BOINC\slots\0\Lib\site-packages\atom_openmm\openmm_async_re.py", line 434, in __init__
self._exit("Error when creating replica.")
File "D:\BOINC\slots\0\Lib\site-packages\atom_openmm\async_re.py", line 69, in _exit
self.checkpointJob()
File "D:\BOINC\slots\0\Lib\site-packages\atom_openmm\openmm_async_re.py", line 48, in checkpointJob
self.update_state_of_replica(repl)
File "D:\BOINC\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 "D:\BOINC\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'
14:31:54 (29340): C:/Windows/system32/cmd.exe exited; CPU time 0.000000
14:31:54 (29340): app exit status: 0x16
14:31:54 (29340): called boinc_finish(195)
0 bytes in 0 Free Blocks.
176 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: 221412 bytes.
Dumping objects ->
{1548} normal block at 0x0000024286CD5EB0, 48 bytes long.
Data: <PATH=D:\BOINC\sl> 50 41 54 48 3D 44 3A 5C 42 4F 49 4E 43 5C 73 6C
{1537} normal block at 0x0000024286CCFED0, 32 bytes long.
Data: <HOME=D:\BOINC\sl> 48 4F 4D 45 3D 44 3A 5C 42 4F 49 4E 43 5C 73 6C
{1526} normal block at 0x0000024286CD0230, 32 bytes long.
Data: <TMP=D:\BOINC\slo> 54 4D 50 3D 44 3A 5C 42 4F 49 4E 43 5C 73 6C 6F
{1515} normal block at 0x0000024286CCF9F0, 32 bytes long.
Data: <TEMP=D:\BOINC\sl> 54 45 4D 50 3D 44 3A 5C 42 4F 49 4E 43 5C 73 6C
{1504} normal block at 0x0000024286CCF930, 32 bytes long.
Data: <TMPDIR=D:\BOINC\> 54 4D 50 44 49 52 3D 44 3A 5C 42 4F 49 4E 43 5C
{1473} normal block at 0x0000024286CD5F20, 48 bytes long.
Data: <PATH=D:\BOINC\sl> 50 41 54 48 3D 44 3A 5C 42 4F 49 4E 43 5C 73 6C
..\api\boinc_api.cpp(309) : {1460} normal block at 0x0000024286CD43D0, 8 bytes long.
Data: < B > 00 00 C0 86 42 02 00 00
{306} normal block at 0x0000024286CD4290, 8 bytes long.
Data: < b B > 80 62 CD 86 42 02 00 00
{297} normal block at 0x0000024286CCEBF0, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
{296} normal block at 0x0000024286CD4470, 16 bytes long.
Data: <xY B > 78 59 CD 86 42 02 00 00 00 00 00 00 00 00 00 00
{295} normal block at 0x0000024286CD4650, 16 bytes long.
Data: <PY B > 50 59 CD 86 42 02 00 00 00 00 00 00 00 00 00 00
{294} normal block at 0x0000024286CCFD50, 32 bytes long.
Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D
{293} normal block at 0x0000024286CD51E0, 16 bytes long.
Data: <(Y B > 28 59 CD 86 42 02 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x0000024286CD50F0, 16 bytes long.
Data: < Y B > 00 59 CD 86 42 02 00 00 00 00 00 00 00 00 00 00
{291} normal block at 0x0000024286CD4600, 16 bytes long.
Data: < X B > D8 58 CD 86 42 02 00 00 00 00 00 00 00 00 00 00
{290} normal block at 0x0000024286CD46A0, 16 bytes long.
Data: < X B > B0 58 CD 86 42 02 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x0000024286CD5C80, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{288} normal block at 0x0000024286CD4510, 16 bytes long.
Data: <8 B > 38 F0 CB 86 42 02 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x0000024286CCFA50, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{286} normal block at 0x0000024286CD4880, 16 bytes long.
Data: < B > 10 F0 CB 86 42 02 00 00 00 00 00 00 00 00 00 00
{284} normal block at 0x0000024286CD47E0, 16 bytes long.
Data: < B > E8 EF CB 86 42 02 00 00 00 00 00 00 00 00 00 00
{283} normal block at 0x0000024286CD4EC0, 16 bytes long.
Data: < B > C0 EF CB 86 42 02 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x0000024286CD44C0, 16 bytes long.
Data: < B > 98 EF CB 86 42 02 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x0000024286CD50A0, 16 bytes long.
Data: <p B > 70 EF CB 86 42 02 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x0000024286CD42E0, 16 bytes long.
Data: <H B > 48 EF CB 86 42 02 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x0000024286CD06B0, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{278} normal block at 0x0000024286CD5140, 16 bytes long.
Data: < B > 20 EF CB 86 42 02 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x0000024286CBEF20, 320 bytes long.
Data: <@Q B B > 40 51 CD 86 42 02 00 00 B0 06 CD 86 42 02 00 00
{276} normal block at 0x0000024286CD5050, 16 bytes long.
Data: < X B > 90 58 CD 86 42 02 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x0000024286CD4970, 16 bytes long.
Data: <hX B > 68 58 CD 86 42 02 00 00 00 00 00 00 00 00 00 00
{274} normal block at 0x0000024286CCFCF0, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{273} normal block at 0x0000024286CD4B00, 16 bytes long.
Data: <@X B > 40 58 CD 86 42 02 00 00 00 00 00 00 00 00 00 00
{272} normal block at 0x0000024286CD0530, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{271} normal block at 0x0000024286CD45B0, 16 bytes long.
Data: < W B > 88 57 CD 86 42 02 00 00 00 00 00 00 00 00 00 00
{270} normal block at 0x0000024286CD4920, 16 bytes long.
Data: <`W B > 60 57 CD 86 42 02 00 00 00 00 00 00 00 00 00 00
{269} normal block at 0x0000024286CD4BF0, 16 bytes long.
Data: <8W B > 38 57 CD 86 42 02 00 00 00 00 00 00 00 00 00 00
{268} normal block at 0x0000024286CD5000, 16 bytes long.
Data: < W B > 10 57 CD 86 42 02 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x0000024286CD4D30, 16 bytes long.
Data: < V B > E8 56 CD 86 42 02 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x0000024286CD4560, 16 bytes long.
Data: < V B > C0 56 CD 86 42 02 00 00 00 00 00 00 00 00 00 00
{264} normal block at 0x0000024286CD4DD0, 16 bytes long.
Data: <p B > 70 E3 CC 86 42 02 00 00 00 00 00 00 00 00 00 00
{263} normal block at 0x0000024286CCE370, 40 bytes long.
Data: < M B _ B > D0 4D CD 86 42 02 00 00 20 5F CD 86 42 02 00 00
{262} normal block at 0x0000024286CD4F10, 16 bytes long.
Data: < V B > A0 56 CD 86 42 02 00 00 00 00 00 00 00 00 00 00
{261} normal block at 0x0000024286CD4D80, 16 bytes long.
Data: <xV B > 78 56 CD 86 42 02 00 00 00 00 00 00 00 00 00 00
{260} normal block at 0x0000024286CD0170, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{259} normal block at 0x0000024286CD4FB0, 16 bytes long.
Data: <PV B > 50 56 CD 86 42 02 00 00 00 00 00 00 00 00 00 00
{258} normal block at 0x0000024286CD5650, 992 bytes long.
Data: < O B p B > B0 4F CD 86 42 02 00 00 70 01 CD 86 42 02 00 00
{94} normal block at 0x0000024286CCFF90, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{93} normal block at 0x0000024286CCD0C0, 16 bytes long.
Data: < B > D0 F3 CB 86 42 02 00 00 00 00 00 00 00 00 00 00
{92} normal block at 0x0000024286CBF3D0, 40 bytes long.
Data: < B B > C0 D0 CC 86 42 02 00 00 90 FF CC 86 42 02 00 00
{71} normal block at 0x0000024286CCD7F0, 16 bytes long.
Data: < > 80 EA A5 D5 F6 7F 00 00 00 00 00 00 00 00 00 00
{70} normal block at 0x0000024286CCCD00, 16 bytes long.
Data: <@ > 40 E9 A5 D5 F6 7F 00 00 00 00 00 00 00 00 00 00
{69} normal block at 0x0000024286CCCA30, 16 bytes long.
Data: < W > F8 57 A2 D5 F6 7F 00 00 00 00 00 00 00 00 00 00
{68} normal block at 0x0000024286CCCCB0, 16 bytes long.
Data: < W > D8 57 A2 D5 F6 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x0000024286CCCC60, 16 bytes long.
Data: <P > 50 04 A2 D5 F6 7F 00 00 00 00 00 00 00 00 00 00
{66} normal block at 0x0000024286CCD7A0, 16 bytes long.
Data: <0 > 30 04 A2 D5 F6 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x0000024286CCCC10, 16 bytes long.
Data: < > E0 02 A2 D5 F6 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x0000024286CCCD50, 16 bytes long.
Data: < > 10 04 A2 D5 F6 7F 00 00 00 00 00 00 00 00 00 00
{63} normal block at 0x0000024286CCD2A0, 16 bytes long.
Data: <p > 70 04 A2 D5 F6 7F 00 00 00 00 00 00 00 00 00 00
{62} normal block at 0x0000024286CCD070, 16 bytes long.
Data: < > 18 C0 A0 D5 F6 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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