Task 38608695
| Name | p38_A27_A28_r0_2-QUICO_ATM_OpenFF_p38-1-6-RND0865_2 |
| Workunit | 31561857 |
| Created | 14 Apr 2026, 17:49:14 UTC |
| Sent | 14 Apr 2026, 17:49:16 UTC |
| Report deadline | 19 Apr 2026, 17:49:16 UTC |
| Received | 14 Apr 2026, 17:57:17 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 39 sec |
| CPU time | 28 sec |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 12,744.92 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 386.11 MB |
| Peak swap size | 6.03 GB |
| Peak disk usage | 3.76 GB |
Stderr output
<core_client_version>8.2.9</core_client_version>
<![CDATA[
<message>
Le syst�me d�exploitation ne peut pas ex�cuter (null).
(0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
19:52:07 (3632): wrapper (7.9.26016): starting
19:52:07 (3632): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A27_A28_0.pdb
QB_A27_A28_0.xml
QB_A27_A28.inpcrd
QB_A27_A28_input.yaml
QB_A27_A28.pdb
QB_A27_A28.prmtop
QB_A27_A28_sys.xml
run.bat
run.sh
19:52:08 (3632): Library/usr/bin/tar.exe exited; CPU time 0.000000
19:52:08 (3632): 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"
19:52:53 (3632): C:/Windows/system32/cmd.exe exited; CPU time 28.062500
19:52:53 (3632): app exit status: 0x16
19:52:53 (3632): 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: 766605 bytes.
Dumping objects ->
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{3835270} normal block at 0x000001F45BF14F20, 48 bytes long.
Data: <HOME=E:\Programm> 48 4F 4D 45 3D 45 3A 5C 50 72 6F 67 72 61 6D 6D
{3835259} normal block at 0x000001F45BF15540, 48 bytes long.
Data: <TMP=E:\Programme> 54 4D 50 3D 45 3A 5C 50 72 6F 67 72 61 6D 6D 65
{3835248} normal block at 0x000001F45BF15930, 48 bytes long.
Data: <TEMP=E:\Programm> 54 45 4D 50 3D 45 3A 5C 50 72 6F 67 72 61 6D 6D
{3835237} normal block at 0x000001F45BF15770, 48 bytes long.
Data: <TMPDIR=E:\Progra> 54 4D 50 44 49 52 3D 45 3A 5C 50 72 6F 67 72 61
{3835206} normal block at 0x000001F45BE3E8F0, 64 bytes long.
Data: <PATH=E:\Programm> 50 41 54 48 3D 45 3A 5C 50 72 6F 67 72 61 6D 6D
{3835195} normal block at 0x000001F45BDDB260, 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) : {3835192} normal block at 0x000001F45A23DBF0, 8 bytes long.
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{3833957} normal block at 0x000001F45A23D420, 8 bytes long.
Data: <àÖ"Zô > E0 D6 22 5A F4 01 00 00
..\zip\boinc_zip.cpp(122) : {310} normal block at 0x000001F45A230FD0, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{295} normal block at 0x000001F45A232670, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
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Data: <`{$Zô > 60 7B 24 5A F4 01 00 00 00 00 00 00 00 00 00 00
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{287} normal block at 0x000001F45A245420, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{286} normal block at 0x000001F45A246B70, 16 bytes long.
Data: < #Zô > 18 07 23 5A F4 01 00 00 00 00 00 00 00 00 00 00
{285} normal block at 0x000001F45A241950, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{284} normal block at 0x000001F45A2477F0, 16 bytes long.
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{282} normal block at 0x000001F45A247110, 16 bytes long.
Data: <È #Zô > C8 06 23 5A F4 01 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x000001F45A246D50, 16 bytes long.
Data: <  #Zô > A0 06 23 5A F4 01 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x000001F45A246F30, 16 bytes long.
Data: <x #Zô > 78 06 23 5A F4 01 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x000001F45A246940, 16 bytes long.
Data: <P #Zô > 50 06 23 5A F4 01 00 00 00 00 00 00 00 00 00 00
{278} normal block at 0x000001F45A246EE0, 16 bytes long.
Data: <( #Zô > 28 06 23 5A F4 01 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x000001F45A241470, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{276} normal block at 0x000001F45A247520, 16 bytes long.
Data: < #Zô > 00 06 23 5A F4 01 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x000001F45A230600, 320 bytes long.
Data: < u$Zô p $Zô > 20 75 24 5A F4 01 00 00 70 14 24 5A F4 01 00 00
{274} normal block at 0x000001F45A246E40, 16 bytes long.
Data: <ðz$Zô > F0 7A 24 5A F4 01 00 00 00 00 00 00 00 00 00 00
{273} normal block at 0x000001F45A247200, 16 bytes long.
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{272} normal block at 0x000001F45A241890, 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 0x000001F45A247250, 16 bytes long.
Data: < z$Zô > A0 7A 24 5A F4 01 00 00 00 00 00 00 00 00 00 00
{270} normal block at 0x000001F45A240AB0, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{269} normal block at 0x000001F45A2477A0, 16 bytes long.
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{268} normal block at 0x000001F45A247390, 16 bytes long.
Data: <Ày$Zô > C0 79 24 5A F4 01 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x000001F45A246DF0, 16 bytes long.
Data: < y$Zô > 98 79 24 5A F4 01 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x000001F45A246A30, 16 bytes long.
Data: <py$Zô > 70 79 24 5A F4 01 00 00 00 00 00 00 00 00 00 00
{265} normal block at 0x000001F45A247700, 16 bytes long.
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{264} normal block at 0x000001F45A246D00, 16 bytes long.
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{262} normal block at 0x000001F45A246FD0, 16 bytes long.
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{261} normal block at 0x000001F45A2456C0, 40 bytes long.
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{260} normal block at 0x000001F45A246DA0, 16 bytes long.
Data: < y$Zô > 00 79 24 5A F4 01 00 00 00 00 00 00 00 00 00 00
{259} normal block at 0x000001F45A2475C0, 16 bytes long.
Data: <Øx$Zô > D8 78 24 5A F4 01 00 00 00 00 00 00 00 00 00 00
{258} normal block at 0x000001F45A241590, 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 0x000001F45A246CB0, 16 bytes long.
Data: <°x$Zô > B0 78 24 5A F4 01 00 00 00 00 00 00 00 00 00 00
{256} normal block at 0x000001F45A2478B0, 992 bytes long.
Data: <°l$Zô $Zô > B0 6C 24 5A F4 01 00 00 90 15 24 5A F4 01 00 00
{92} normal block at 0x000001F45A241410, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{91} normal block at 0x000001F45A23DEC0, 16 bytes long.
Data: < U$Zô > 00 55 24 5A F4 01 00 00 00 00 00 00 00 00 00 00
{90} normal block at 0x000001F45A245500, 40 bytes long.
Data: <ÀÞ#Zô $Zô > C0 DE 23 5A F4 01 00 00 10 14 24 5A F4 01 00 00
{69} normal block at 0x000001F45A23D5B0, 16 bytes long.
Data: < êÍL÷ > 80 EA CD 4C F7 7F 00 00 00 00 00 00 00 00 00 00
{68} normal block at 0x000001F45A23D380, 16 bytes long.
Data: <@éÍL÷ > 40 E9 CD 4C F7 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x000001F45A23DAB0, 16 bytes long.
Data: <øWÊL÷ > F8 57 CA 4C F7 7F 00 00 00 00 00 00 00 00 00 00
{66} normal block at 0x000001F45A23D8D0, 16 bytes long.
Data: <ØWÊL÷ > D8 57 CA 4C F7 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x000001F45A23D290, 16 bytes long.
Data: <P ÊL÷ > 50 04 CA 4C F7 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x000001F45A23D880, 16 bytes long.
Data: <0 ÊL÷ > 30 04 CA 4C F7 7F 00 00 00 00 00 00 00 00 00 00
{63} normal block at 0x000001F45A23DA10, 16 bytes long.
Data: <à ÊL÷ > E0 02 CA 4C F7 7F 00 00 00 00 00 00 00 00 00 00
{62} normal block at 0x000001F45A23D1F0, 16 bytes long.
Data: < ÊL÷ > 10 04 CA 4C F7 7F 00 00 00 00 00 00 00 00 00 00
{61} normal block at 0x000001F45A23DF60, 16 bytes long.
Data: <p ÊL÷ > 70 04 CA 4C F7 7F 00 00 00 00 00 00 00 00 00 00
{60} normal block at 0x000001F45A23D560, 16 bytes long.
Data: < ÀÈL÷ > 18 C0 C8 4C F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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