Task 38611654
| Name | p38_A13_A31_r0_1-QUICO_ATM_OpenFF_p38-2-6-RND1618_0 |
| Workunit | 31564358 |
| Created | 15 Apr 2026, 21:58:36 UTC |
| Sent | 15 Apr 2026, 21:58:38 UTC |
| Report deadline | 20 Apr 2026, 21:58:38 UTC |
| Received | 15 Apr 2026, 22:07:38 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 195 (0x000000C3) EXIT_CHILD_FAILED |
| Computer ID | 643084 |
| Run time | 6 min 45 sec |
| CPU time | 3 min 10 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 | 483.68 MB |
| Peak swap size | 6.12 GB |
| Peak disk usage | 3.00 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>
00:00:22 (20908): wrapper (7.9.26016): starting
00:00:22 (20908): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A13_A31_0.pdb
QB_A13_A31_0.xml
QB_A13_A31.inpcrd
QB_A13_A31_input.yaml
QB_A13_A31.pdb
QB_A13_A31.prmtop
QB_A13_A31_sys.xml
run.bat
run.sh
00:00:32 (20908): Library/usr/bin/tar.exe exited; CPU time 0.015625
00:00:32 (20908): 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\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 'E:\Programmes\BOINC\Données\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.
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\12\Scripts\rbfe_production.exe\__main__.py", line 7, in <module>
File "E:\Programmes\BOINC\Données\slots\12\Lib\site-packages\atom_openmm\rbfe_production.py", line 29, in rbfe_production
rx = openmm_job_RBFE(
^^^^^^^^^^^^^^^^
File "E:\Programmes\BOINC\Données\slots\12\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\12\Lib\site-packages\atom_openmm\ommworker.py", line 53, in __init__
self.start_worker()
File "E:\Programmes\BOINC\Données\slots\12\Lib\site-packages\atom_openmm\ommworker.py", line 444, in start_worker
self._openmm_worker_makecontext()
File "E:\Programmes\BOINC\Données\slots\12\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\12\Lib\site-packages\openmm\openmm.py", line 17238, in getPlatformByName
return _openmm.Platform_getPlatformByName(name)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
openmm.OpenMMException: There is no registered Platform called "CUDA"
00:05:41 (20908): C:/Windows/system32/cmd.exe exited; CPU time 190.671875
00:05:41 (20908): app exit status: 0x16
00:05:41 (20908): 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: 4421225 bytes.
Dumping objects ->
{3835281} normal block at 0x000002439DA9E6C0, 64 bytes long.
Data: <PATH=E:\Programm> 50 41 54 48 3D 45 3A 5C 50 72 6F 67 72 61 6D 6D
{3835270} normal block at 0x000002439DAFB510, 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 0x000002439DAFACC0, 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 0x000002439DAFB900, 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 0x000002439DAFB3C0, 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 0x000002439DA9E040, 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 0x000002439DAF8AF0, 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 0x000002439BE3D660, 8 bytes long.
Data: < ݛC > 00 00 DD 9B 43 02 00 00
{3834565} normal block at 0x000002439DAF91D0, 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 0x000002439BE3DE80, 8 bytes long.
Data: <àÖâ›C > E0 D6 E2 9B 43 02 00 00
..\zip\boinc_zip.cpp(122) : {310} normal block at 0x000002439BE314E0, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{295} normal block at 0x000002439BE31A20, 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 0x000002439BE45640, 16 bytes long.
Data: <(iä›C > 28 69 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{293} normal block at 0x000002439BE45AA0, 16 bytes long.
Data: < iä›C > 00 69 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x000002439BE40B20, 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 0x000002439BE464F0, 16 bytes long.
Data: <Øhä›C > D8 68 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{290} normal block at 0x000002439BE459B0, 16 bytes long.
Data: <°hä›C > B0 68 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x000002439BE46450, 16 bytes long.
Data: < hä›C > 88 68 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{288} normal block at 0x000002439BE46360, 16 bytes long.
Data: <`hä›C > 60 68 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x000002439BE40440, 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 0x000002439BE46590, 16 bytes long.
Data: <( ã›C > 28 07 E3 9B 43 02 00 00 00 00 00 00 00 00 00 00
{285} normal block at 0x000002439BE40AC0, 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 0x000002439BE46310, 16 bytes long.
Data: < ã›C > 00 07 E3 9B 43 02 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x000002439BE463B0, 16 bytes long.
Data: <Ø ã›C > D8 06 E3 9B 43 02 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x000002439BE46270, 16 bytes long.
Data: <° ã›C > B0 06 E3 9B 43 02 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x000002439BE45D70, 16 bytes long.
Data: < ã›C > 88 06 E3 9B 43 02 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x000002439BE45F50, 16 bytes long.
Data: <` ã›C > 60 06 E3 9B 43 02 00 00 00 00 00 00 00 00 00 00
{278} normal block at 0x000002439BE456E0, 16 bytes long.
Data: <8 ã›C > 38 06 E3 9B 43 02 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x000002439BE40CA0, 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 0x000002439BE45960, 16 bytes long.
Data: < ã›C > 10 06 E3 9B 43 02 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x000002439BE30610, 320 bytes long.
Data: <`Yä›C   ä›C > 60 59 E4 9B 43 02 00 00 A0 0C E4 9B 43 02 00 00
{274} normal block at 0x000002439BE46400, 16 bytes long.
Data: <@hä›C > 40 68 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{273} normal block at 0x000002439BE462C0, 16 bytes long.
Data: < hä›C > 18 68 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{272} normal block at 0x000002439BE41300, 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 0x000002439BE45910, 16 bytes long.
Data: <ðgä›C > F0 67 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{270} normal block at 0x000002439BE40F40, 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 0x000002439BE46220, 16 bytes long.
Data: <8gä›C > 38 67 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{268} normal block at 0x000002439BE460E0, 16 bytes long.
Data: < gä›C > 10 67 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x000002439BE458C0, 16 bytes long.
Data: <èfä›C > E8 66 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x000002439BE46040, 16 bytes long.
Data: <Àfä›C > C0 66 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{265} normal block at 0x000002439BE457D0, 16 bytes long.
Data: < fä›C > 98 66 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{264} normal block at 0x000002439BE45C30, 16 bytes long.
Data: <pfä›C > 70 66 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{262} normal block at 0x000002439BE464A0, 16 bytes long.
Data: <  ä›C > A0 01 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{261} normal block at 0x000002439BE401A0, 40 bytes long.
Data: < dä›C @à© C > A0 64 E4 9B 43 02 00 00 40 E0 A9 9D 43 02 00 00
{260} normal block at 0x000002439BE45780, 16 bytes long.
Data: <Pfä›C > 50 66 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{259} normal block at 0x000002439BE45730, 16 bytes long.
Data: <(fä›C > 28 66 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{258} normal block at 0x000002439BE412A0, 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 0x000002439BE45690, 16 bytes long.
Data: < fä›C > 00 66 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{256} normal block at 0x000002439BE46600, 992 bytes long.
Data: < Vä›C   ä›C > 90 56 E4 9B 43 02 00 00 A0 12 E4 9B 43 02 00 00
{92} normal block at 0x000002439BE41240, 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 0x000002439BE3D7F0, 16 bytes long.
Data: <° ä›C > B0 04 E4 9B 43 02 00 00 00 00 00 00 00 00 00 00
{90} normal block at 0x000002439BE404B0, 40 bytes long.
Data: <ð×ã›C @ ä›C > F0 D7 E3 9B 43 02 00 00 40 12 E4 9B 43 02 00 00
{69} normal block at 0x000002439BE3D2F0, 16 bytes long.
Data: < êÒZ÷ > 80 EA D2 5A F7 7F 00 00 00 00 00 00 00 00 00 00
{68} normal block at 0x000002439BE3D1B0, 16 bytes long.
Data: <@éÒZ÷ > 40 E9 D2 5A F7 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x000002439BE3DDE0, 16 bytes long.
Data: <øWÏZ÷ > F8 57 CF 5A F7 7F 00 00 00 00 00 00 00 00 00 00
{66} normal block at 0x000002439BE3DCA0, 16 bytes long.
Data: <ØWÏZ÷ > D8 57 CF 5A F7 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x000002439BE3D7A0, 16 bytes long.
Data: <P ÏZ÷ > 50 04 CF 5A F7 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x000002439BE3D2A0, 16 bytes long.
Data: <0 ÏZ÷ > 30 04 CF 5A F7 7F 00 00 00 00 00 00 00 00 00 00
{63} normal block at 0x000002439BE3D4D0, 16 bytes long.
Data: <à ÏZ÷ > E0 02 CF 5A F7 7F 00 00 00 00 00 00 00 00 00 00
{62} normal block at 0x000002439BE3DB60, 16 bytes long.
Data: < ÏZ÷ > 10 04 CF 5A F7 7F 00 00 00 00 00 00 00 00 00 00
{61} normal block at 0x000002439BE3DAC0, 16 bytes long.
Data: <p ÏZ÷ > 70 04 CF 5A F7 7F 00 00 00 00 00 00 00 00 00 00
{60} normal block at 0x000002439BE3D250, 16 bytes long.
Data: < ÀÍZ÷ > 18 C0 CD 5A F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
©2026 Universitat Pompeu Fabra