| Name | test_1130-GPUGRID_TEST_ATM_2STEP_20261024-1-2-RND5310_0 |
| Workunit | 31604384 |
| Created | 24 Oct 2026, 14:57:14 UTC |
| Sent | 24 Oct 2026, 15:04:16 UTC |
| Report deadline | 29 Oct 2026, 15:04:16 UTC |
| Received | 25 Oct 2026, 1:45:10 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 195 (0x000000C3) EXIT_CHILD_FAILED |
| Computer ID | 630626 |
| Run time | 15 min 52 sec |
| CPU time | 15 min 52 sec |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 40,323.63 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 735.33 MB |
| Peak swap size | 5.45 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>
20:31:48 (38780): wrapper (7.9.26016): starting
20:31:48 (38780): 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
20:31:49 (38780): Library/usr/bin/tar.exe exited; CPU time 0.015625
20:31:49 (38780): 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) : {3835488} normal block at 0x00000273EA46E140, 8 bytes long.
Data: < B s > 00 00 42 EA 73 02 00 00
..\lib\diagnostics_win.cpp(417) : {3833960} normal block at 0x00000273EC0D43C0, 1080 bytes long.
Data: < $ d > BC 24 00 00 CD CD CD CD 64 02 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {312} normal block at 0x00000273EA471CC0, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
20:38:24 (5192): wrapper (7.9.26016): starting
20:38:24 (5192): 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\12\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\12\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) : {1833} normal block at 0x000001BBCA8962D0, 8 bytes long.
Data: < > 00 00 DB CA BB 01 00 00
..\lib\diagnostics_win.cpp(417) : {305} normal block at 0x000001BBCA897160, 1080 bytes long.
Data: < h D > A0 68 00 00 CD CD CD CD 44 01 00 00 00 00 00 00
Object dump complete.
21:11:24 (20580): wrapper (7.9.26016): starting
21:11:24 (20580): 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\12\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1833} normal block at 0x000002121BD05FF0, 8 bytes long.
Data: < % > 00 00 25 1C 12 02 00 00
..\lib\diagnostics_win.cpp(417) : {305} normal block at 0x000002121BD071F0, 1080 bytes long.
Data: <l H > 6C 16 00 00 CD CD CD CD 48 01 00 00 00 00 00 00
Object dump complete.
21:39:13 (6880): wrapper (7.9.26016): starting
21:39:13 (6880): 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\12\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1833} normal block at 0x00000137A6765FF0, 8 bytes long.
Data: < l 7 > 00 00 6C A6 37 01 00 00
..\lib\diagnostics_win.cpp(417) : {305} normal block at 0x00000137A67671F0, 1080 bytes long.
Data: < f L > 88 66 00 00 CD CD CD CD 4C 01 00 00 00 00 00 00
Object dump complete.
21:42:48 (10764): wrapper (7.9.26016): starting
21:42:48 (10764): 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\12\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Traceback (most recent call last):
File "C:\ProgramData\BOINC\slots\12\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\12\Lib\site-packages\atom_openmm\ommreplica.py", line 41, in __init__
self.load_checkpoint()
File "C:\ProgramData\BOINC\slots\12\Lib\site-packages\atom_openmm\ommreplica.py", line 79, in load_checkpoint
self.worker.simulation.loadState(ckptfile)
File "C:\ProgramData\BOINC\slots\12\Lib\site-packages\openmm\app\simulation.py", line 363, in loadState
self.context.setState(mm.XmlSerializer.deserialize(xml))
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\ProgramData\BOINC\slots\12\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\12\Scripts\rbfe_production.exe\__main__.py", line 7, in <module>
File "C:\ProgramData\BOINC\slots\12\Lib\site-packages\atom_openmm\rbfe_production.py", line 29, in rbfe_production
rx = openmm_job_RBFE(
^^^^^^^^^^^^^^^^
File "C:\ProgramData\BOINC\slots\12\Lib\site-packages\atom_openmm\openmm_async_re.py", line 434, in __init__
self._exit("Error when creating replica.")
File "C:\ProgramData\BOINC\slots\12\Lib\site-packages\atom_openmm\async_re.py", line 69, in _exit
self.checkpointJob()
File "C:\ProgramData\BOINC\slots\12\Lib\site-packages\atom_openmm\openmm_async_re.py", line 48, in checkpointJob
self.update_state_of_replica(repl)
File "C:\ProgramData\BOINC\slots\12\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\12\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'
21:43:13 (10764): C:/Windows/system32/cmd.exe exited; CPU time 18.828125
21:43:13 (10764): app exit status: 0x16
21:43:13 (10764): 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: 555907 bytes.
Dumping objects ->
{1921} normal block at 0x00000207B3245900, 48 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{1910} normal block at 0x00000207B3245890, 48 bytes long.
Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{1899} normal block at 0x00000207B3245510, 48 bytes long.
Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61
{1888} normal block at 0x00000207B32453C0, 48 bytes long.
Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{1877} normal block at 0x00000207B32455F0, 48 bytes long.
Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61
{1846} normal block at 0x00000207B3239680, 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) : {1833} normal block at 0x00000207B3246770, 8 bytes long.
Data: < i > 00 00 69 B3 07 02 00 00
{306} normal block at 0x00000207B3246AE0, 8 bytes long.
Data: < q$ > F0 71 24 B3 07 02 00 00
{297} normal block at 0x00000207B3237140, 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 0x00000207B32469F0, 16 bytes long.
Data: < p$ > F8 70 24 B3 07 02 00 00 00 00 00 00 00 00 00 00
{295} normal block at 0x00000207B32462C0, 16 bytes long.
Data: < p$ > D0 70 24 B3 07 02 00 00 00 00 00 00 00 00 00 00
{294} normal block at 0x00000207B323FD10, 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 0x00000207B3246180, 16 bytes long.
Data: < p$ > A8 70 24 B3 07 02 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x00000207B32465E0, 16 bytes long.
Data: < p$ > 80 70 24 B3 07 02 00 00 00 00 00 00 00 00 00 00
{291} normal block at 0x00000207B3245F00, 16 bytes long.
Data: <Xp$ > 58 70 24 B3 07 02 00 00 00 00 00 00 00 00 00 00
{290} normal block at 0x00000207B3246360, 16 bytes long.
Data: <0p$ > 30 70 24 B3 07 02 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x00000207B3245430, 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 0x00000207B3246900, 16 bytes long.
Data: < " > B8 F7 22 B3 07 02 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x00000207B323FCB0, 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 0x00000207B3246D10, 16 bytes long.
Data: < " > 90 F7 22 B3 07 02 00 00 00 00 00 00 00 00 00 00
{284} normal block at 0x00000207B3245E60, 16 bytes long.
Data: <h " > 68 F7 22 B3 07 02 00 00 00 00 00 00 00 00 00 00
{283} normal block at 0x00000207B3246680, 16 bytes long.
Data: <@ " > 40 F7 22 B3 07 02 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x00000207B32463B0, 16 bytes long.
Data: < " > 18 F7 22 B3 07 02 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x00000207B3246950, 16 bytes long.
Data: < " > F0 F6 22 B3 07 02 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x00000207B3246590, 16 bytes long.
Data: < " > C8 F6 22 B3 07 02 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x00000207B3240310, 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 0x00000207B3246A90, 16 bytes long.
Data: < " > A0 F6 22 B3 07 02 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x00000207B322F6A0, 320 bytes long.
Data: < j$ $ > 90 6A 24 B3 07 02 00 00 10 03 24 B3 07 02 00 00
{276} normal block at 0x00000207B32468B0, 16 bytes long.
Data: < p$ > 10 70 24 B3 07 02 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x00000207B3246270, 16 bytes long.
Data: < o$ > E8 6F 24 B3 07 02 00 00 00 00 00 00 00 00 00 00
{274} normal block at 0x00000207B32402B0, 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 0x00000207B3246540, 16 bytes long.
Data: < o$ > C0 6F 24 B3 07 02 00 00 00 00 00 00 00 00 00 00
{272} normal block at 0x00000207B323FF50, 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 0x00000207B3246C20, 16 bytes long.
Data: < o$ > 08 6F 24 B3 07 02 00 00 00 00 00 00 00 00 00 00
{270} normal block at 0x00000207B3246220, 16 bytes long.
Data: < n$ > E0 6E 24 B3 07 02 00 00 00 00 00 00 00 00 00 00
{269} normal block at 0x00000207B3246130, 16 bytes long.
Data: < n$ > B8 6E 24 B3 07 02 00 00 00 00 00 00 00 00 00 00
{268} normal block at 0x00000207B32460E0, 16 bytes long.
Data: < n$ > 90 6E 24 B3 07 02 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x00000207B3246720, 16 bytes long.
Data: <hn$ > 68 6E 24 B3 07 02 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x00000207B32461D0, 16 bytes long.
Data: <@n$ > 40 6E 24 B3 07 02 00 00 00 00 00 00 00 00 00 00
{264} normal block at 0x00000207B32466D0, 16 bytes long.
Data: < R$ > E0 52 24 B3 07 02 00 00 00 00 00 00 00 00 00 00
{263} normal block at 0x00000207B32452E0, 40 bytes long.
Data: < f$ # > D0 66 24 B3 07 02 00 00 80 96 23 B3 07 02 00 00
{262} normal block at 0x00000207B3246860, 16 bytes long.
Data: < n$ > 20 6E 24 B3 07 02 00 00 00 00 00 00 00 00 00 00
{261} normal block at 0x00000207B3246400, 16 bytes long.
Data: < m$ > F8 6D 24 B3 07 02 00 00 00 00 00 00 00 00 00 00
{260} normal block at 0x00000207B323FEF0, 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 0x00000207B32464F0, 16 bytes long.
Data: < m$ > D0 6D 24 B3 07 02 00 00 00 00 00 00 00 00 00 00
{258} normal block at 0x00000207B3246DD0, 992 bytes long.
Data: < d$ # > F0 64 24 B3 07 02 00 00 F0 FE 23 B3 07 02 00 00
{94} normal block at 0x00000207B323F890, 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 0x00000207B323E140, 16 bytes long.
Data: < " > A0 F3 22 B3 07 02 00 00 00 00 00 00 00 00 00 00
{92} normal block at 0x00000207B322F3A0, 40 bytes long.
Data: <@ # # > 40 E1 23 B3 07 02 00 00 90 F8 23 B3 07 02 00 00
{71} normal block at 0x00000207B323E550, 16 bytes long.
Data: < W: > 80 EA 57 3A F7 7F 00 00 00 00 00 00 00 00 00 00
{70} normal block at 0x00000207B323E1E0, 16 bytes long.
Data: <@ W: > 40 E9 57 3A F7 7F 00 00 00 00 00 00 00 00 00 00
{69} normal block at 0x00000207B323E050, 16 bytes long.
Data: < WT: > F8 57 54 3A F7 7F 00 00 00 00 00 00 00 00 00 00
{68} normal block at 0x00000207B323E410, 16 bytes long.
Data: < WT: > D8 57 54 3A F7 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x00000207B323D790, 16 bytes long.
Data: <P T: > 50 04 54 3A F7 7F 00 00 00 00 00 00 00 00 00 00
{66} normal block at 0x00000207B323DD80, 16 bytes long.
Data: <0 T: > 30 04 54 3A F7 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x00000207B323D9C0, 16 bytes long.
Data: < T: > E0 02 54 3A F7 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x00000207B323E190, 16 bytes long.
Data: < T: > 10 04 54 3A F7 7F 00 00 00 00 00 00 00 00 00 00
{63} normal block at 0x00000207B323E000, 16 bytes long.
Data: <p T: > 70 04 54 3A F7 7F 00 00 00 00 00 00 00 00 00 00
{62} normal block at 0x00000207B323DE20, 16 bytes long.
Data: < R: > 18 C0 52 3A F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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