Task 38599412
| Name | p38_A27_A14_r0_4-QUICO_ATM_GAFF2_NAGL_p38-1-6-RND8558_3 |
| Workunit | 31553934 |
| Created | 8 Apr 2026, 17:39:39 UTC |
| Sent | 8 Apr 2026, 17:39:45 UTC |
| Report deadline | 13 Apr 2026, 17:39:45 UTC |
| Received | 8 Apr 2026, 17:43:27 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 195 (0x000000C3) EXIT_CHILD_FAILED |
| Computer ID | 643084 |
| Run time | 1 min 37 sec |
| CPU time | 26 sec |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 12,744.88 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 403.29 MB |
| Peak swap size | 6.05 GB |
| Peak disk usage | 3.11 GB |
Stderr output
<core_client_version>8.2.8</core_client_version>
<![CDATA[
<message>
Le syst�me d�exploitation ne peut pas ex�cuter (null).
(0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
19:40:44 (19248): wrapper (7.9.26016): starting
19:40:44 (19248): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A27_A14_0.pdb
QB_A27_A14_0.xml
QB_A27_A14.inpcrd
QB_A27_A14_input.yaml
QB_A27_A14.pdb
QB_A27_A14.prmtop
QB_A27_A14_sys.xml
run.bat
run.sh
19:40:45 (19248): Library/usr/bin/tar.exe exited; CPU time 0.000000
19:40:45 (19248): 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 'E:\Programmes\BOINC\Données\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 'E:\Programmes\BOINC\Données\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.
Traceback (most recent call last):
File "<frozen runpy>", line 198, in _run_module_as_main
File "<frozen runpy>", line 88, in _run_code
File "E:\Programmes\BOINC\Données\slots\1\Scripts\rbfe_production.exe\__main__.py", line 7, in <module>
File "E:\Programmes\BOINC\Données\slots\1\Lib\site-packages\atom_openmm\rbfe_production.py", line 29, in rbfe_production
rx = openmm_job_RBFE(
^^^^^^^^^^^^^^^^
File "E:\Programmes\BOINC\Données\slots\1\Lib\site-packages\atom_openmm\openmm_async_re.py", line 443, in __init__
self.openmm_workers.append(ommworkercls(self.basename, ommsys, self.keywords, node_info = node, compute = True, logger = self.logger))
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "E:\Programmes\BOINC\Données\slots\1\Lib\site-packages\atom_openmm\ommworker.py", line 53, in __init__
self.start_worker()
File "E:\Programmes\BOINC\Données\slots\1\Lib\site-packages\atom_openmm\ommworker.py", line 444, in start_worker
self._openmm_worker_makecontext()
File "E:\Programmes\BOINC\Données\slots\1\Lib\site-packages\atom_openmm\ommworker.py", line 229, in _openmm_worker_makecontext
self.platform = Platform.getPlatformByName(self.platform_name)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "E:\Programmes\BOINC\Données\slots\1\Lib\site-packages\openmm\openmm.py", line 17238, in getPlatformByName
return _openmm.Platform_getPlatformByName(name)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
openmm.OpenMMException: There is no registered Platform called "CUDA"
19:41:28 (19248): C:/Windows/system32/cmd.exe exited; CPU time 26.687500
19:41:28 (19248): app exit status: 0x16
19:41:28 (19248): called boinc_finish(195)
0 bytes in 0 Free Blocks.
476 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: 754177 bytes.
Dumping objects ->
{3835274} normal block at 0x000001C3E3A5D0D0, 64 bytes long.
Data: <PATH=E:\Programm> 50 41 54 48 3D 45 3A 5C 50 72 6F 67 72 61 6D 6D
{3835263} normal block at 0x000001C3E1E0B110, 48 bytes long.
Data: <HOME=E:\Programm> 48 4F 4D 45 3D 45 3A 5C 50 72 6F 67 72 61 6D 6D
{3835252} normal block at 0x000001C3E1E0B960, 48 bytes long.
Data: <TMP=E:\Programme> 54 4D 50 3D 45 3A 5C 50 72 6F 67 72 61 6D 6D 65
{3835241} normal block at 0x000001C3E1E0B180, 48 bytes long.
Data: <TEMP=E:\Programm> 54 45 4D 50 3D 45 3A 5C 50 72 6F 67 72 61 6D 6D
{3835230} normal block at 0x000001C3E1E0B8F0, 48 bytes long.
Data: <TMPDIR=E:\Progra> 54 4D 50 44 49 52 3D 45 3A 5C 50 72 6F 67 72 61
{3835199} normal block at 0x000001C3E3A5D850, 64 bytes long.
Data: <PATH=E:\Programm> 50 41 54 48 3D 45 3A 5C 50 72 6F 67 72 61 6D 6D
{3835188} normal block at 0x000001C3E3ABED20, 102 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) : {3835185} normal block at 0x000001C3E1DDD6C0, 8 bytes long.
Data: < âà > 00 00 1C E2 C3 01 00 00
{3834562} normal block at 0x000001C3E3ABE7A0, 102 bytes long.
Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65
{3833957} normal block at 0x000001C3E1DDD990, 8 bytes long.
Data: <à×Üáà > E0 D7 DC E1 C3 01 00 00
..\zip\boinc_zip.cpp(122) : {310} normal block at 0x000001C3E1DD0F90, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{295} normal block at 0x000001C3E1DD2260, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
{294} normal block at 0x000001C3E1DE5B40, 16 bytes long.
Data: < gÞáà > 98 67 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{293} normal block at 0x000001C3E1DE62C0, 16 bytes long.
Data: <pgÞáà > 70 67 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x000001C3E1DE1580, 32 bytes long.
Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D
{291} normal block at 0x000001C3E1DE5FA0, 16 bytes long.
Data: <HgÞáà > 48 67 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{290} normal block at 0x000001C3E1DE5E10, 16 bytes long.
Data: < gÞáà > 20 67 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x000001C3E1DE5960, 16 bytes long.
Data: <øfÞáà > F8 66 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{288} normal block at 0x000001C3E1DE5DC0, 16 bytes long.
Data: <ÐfÞáà > D0 66 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x000001C3E1DE04B0, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{286} normal block at 0x000001C3E1DE5C30, 16 bytes long.
Data: <8óÜáà > 38 F3 DC E1 C3 01 00 00 00 00 00 00 00 00 00 00
{285} normal block at 0x000001C3E1DE1220, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{284} normal block at 0x000001C3E1DE6270, 16 bytes long.
Data: < óÜáà > 10 F3 DC E1 C3 01 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x000001C3E1DE5AA0, 16 bytes long.
Data: <èòÜáà > E8 F2 DC E1 C3 01 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x000001C3E1DE5F50, 16 bytes long.
Data: <ÀòÜáà > C0 F2 DC E1 C3 01 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x000001C3E1DE5550, 16 bytes long.
Data: < òÜáà > 98 F2 DC E1 C3 01 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x000001C3E1DE6130, 16 bytes long.
Data: <pòÜáà > 70 F2 DC E1 C3 01 00 00 00 00 00 00 00 00 00 00
{278} normal block at 0x000001C3E1DE6310, 16 bytes long.
Data: <HòÜáà > 48 F2 DC E1 C3 01 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x000001C3E1DE0BC0, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{276} normal block at 0x000001C3E1DE5AF0, 16 bytes long.
Data: < òÜáà > 20 F2 DC E1 C3 01 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x000001C3E1DCF220, 320 bytes long.
Data: <ðZÞáà À Þáà > F0 5A DE E1 C3 01 00 00 C0 0B DE E1 C3 01 00 00
{274} normal block at 0x000001C3E1DE5A50, 16 bytes long.
Data: <°fÞáà > B0 66 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{273} normal block at 0x000001C3E1DE5910, 16 bytes long.
Data: < fÞáà > 88 66 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{272} normal block at 0x000001C3E1DE19A0, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{271} normal block at 0x000001C3E1DE5E60, 16 bytes long.
Data: <`fÞáà > 60 66 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{270} normal block at 0x000001C3E1DE1460, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{269} normal block at 0x000001C3E1DE5500, 16 bytes long.
Data: <¨eÞáà > A8 65 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{268} normal block at 0x000001C3E1DE5FF0, 16 bytes long.
Data: < eÞáà > 80 65 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x000001C3E1DE54B0, 16 bytes long.
Data: <XeÞáà > 58 65 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x000001C3E1DE61D0, 16 bytes long.
Data: <0eÞáà > 30 65 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{265} normal block at 0x000001C3E1DE5A00, 16 bytes long.
Data: < eÞáà > 08 65 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{264} normal block at 0x000001C3E1DE56E0, 16 bytes long.
Data: <àdÞáà > E0 64 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{262} normal block at 0x000001C3E1DE5EB0, 16 bytes long.
Data: <À Þáà > C0 07 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{261} normal block at 0x000001C3E1DE07C0, 40 bytes long.
Data: <°^Þáà PØ¥ãà > B0 5E DE E1 C3 01 00 00 50 D8 A5 E3 C3 01 00 00
{260} normal block at 0x000001C3E1DE55F0, 16 bytes long.
Data: <ÀdÞáà > C0 64 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{259} normal block at 0x000001C3E1DE59B0, 16 bytes long.
Data: < dÞáà > 98 64 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{258} normal block at 0x000001C3E1DE0B60, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{257} normal block at 0x000001C3E1DE60E0, 16 bytes long.
Data: <pdÞáà > 70 64 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{256} normal block at 0x000001C3E1DE6470, 992 bytes long.
Data: <à`Þáà ` Þáà > E0 60 DE E1 C3 01 00 00 60 0B DE E1 C3 01 00 00
{92} normal block at 0x000001C3E1DE1100, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{91} normal block at 0x000001C3E1DDDD50, 16 bytes long.
Data: <P Þáà > 50 07 DE E1 C3 01 00 00 00 00 00 00 00 00 00 00
{90} normal block at 0x000001C3E1DE0750, 40 bytes long.
Data: <PÝÝáà Þáà > 50 DD DD E1 C3 01 00 00 00 11 DE E1 C3 01 00 00
{69} normal block at 0x000001C3E1DDD3F0, 16 bytes long.
Data: < ê 5÷ > 80 EA 09 35 F7 7F 00 00 00 00 00 00 00 00 00 00
{68} normal block at 0x000001C3E1DDD8A0, 16 bytes long.
Data: <@é 5÷ > 40 E9 09 35 F7 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x000001C3E1DDD850, 16 bytes long.
Data: <øW 5÷ > F8 57 06 35 F7 7F 00 00 00 00 00 00 00 00 00 00
{66} normal block at 0x000001C3E1DDD7B0, 16 bytes long.
Data: <ØW 5÷ > D8 57 06 35 F7 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x000001C3E1DDD760, 16 bytes long.
Data: <P 5÷ > 50 04 06 35 F7 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x000001C3E1DDDE90, 16 bytes long.
Data: <0 5÷ > 30 04 06 35 F7 7F 00 00 00 00 00 00 00 00 00 00
{63} normal block at 0x000001C3E1DDD580, 16 bytes long.
Data: <à 5÷ > E0 02 06 35 F7 7F 00 00 00 00 00 00 00 00 00 00
{62} normal block at 0x000001C3E1DDD710, 16 bytes long.
Data: < 5÷ > 10 04 06 35 F7 7F 00 00 00 00 00 00 00 00 00 00
{61} normal block at 0x000001C3E1DDDAD0, 16 bytes long.
Data: <p 5÷ > 70 04 06 35 F7 7F 00 00 00 00 00 00 00 00 00 00
{60} normal block at 0x000001C3E1DDD3A0, 16 bytes long.
Data: < À 5÷ > 18 C0 04 35 F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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