Task 38611888
| Name | MCL1_A41_A06_r0_2-QUICO_ATM_GAFF2_NAGL_MCL1-3-6-RND8361_0 |
| Workunit | 31564561 |
| Created | 16 Apr 2026, 0:36:06 UTC |
| Sent | 16 Apr 2026, 0:36:09 UTC |
| Report deadline | 21 Apr 2026, 0:36:09 UTC |
| Received | 16 Apr 2026, 0:41:25 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 195 (0x000000C3) EXIT_CHILD_FAILED |
| Computer ID | 643084 |
| Run time | 3 min 54 sec |
| CPU time | 1 min 20 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 | 320.18 MB |
| Peak swap size | 5.95 GB |
| Peak disk usage | 2.77 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>
02:37:40 (23980): wrapper (7.9.26016): starting
02:37:40 (23980): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A41_A06_0.pdb
QB_A41_A06_0.xml
QB_A41_A06.inpcrd
QB_A41_A06_input.yaml
QB_A41_A06.pdb
QB_A41_A06.prmtop
QB_A41_A06_sys.xml
run.bat
run.sh
02:37:45 (23980): Library/usr/bin/tar.exe exited; CPU time 0.015625
02:37:45 (23980): 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"
02:40:15 (23980): C:/Windows/system32/cmd.exe exited; CPU time 80.062500
02:40:15 (23980): app exit status: 0x16
02:40:15 (23980): 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: 2316587 bytes.
Dumping objects ->
{3835281} normal block at 0x00000225C288F910, 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 0x00000225C0C4B3B0, 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 0x00000225C0C4B420, 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 0x00000225C0C4B500, 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 0x00000225C0C4BFF0, 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 0x00000225C288EF90, 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 0x00000225C28F0B20, 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 0x00000225C0C1EF90, 8 bytes long.
Data: < Á% > 00 00 0F C1 25 02 00 00
{3834565} normal block at 0x00000225C28F0860, 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 0x00000225C0C1F0D0, 8 bytes long.
Data: <àÖÀÀ% > E0 D6 C0 C0 25 02 00 00
..\zip\boinc_zip.cpp(122) : {310} normal block at 0x00000225C0C10BE0, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{295} normal block at 0x00000225C0C125B0, 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: <( ÂÀ% > 28 88 C2 C0 25 02 00 00 00 00 00 00 00 00 00 00
{293} normal block at 0x00000225C0C280D0, 16 bytes long.
Data: < ÂÀ% > 00 88 C2 C0 25 02 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x00000225C0C232F0, 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 0x00000225C0C27F40, 16 bytes long.
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{290} normal block at 0x00000225C0C27950, 16 bytes long.
Data: <°‡ÂÀ% > B0 87 C2 C0 25 02 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x00000225C0C27E50, 16 bytes long.
Data: < ‡ÂÀ% > 88 87 C2 C0 25 02 00 00 00 00 00 00 00 00 00 00
{288} normal block at 0x00000225C0C28260, 16 bytes long.
Data: <`‡ÂÀ% > 60 87 C2 C0 25 02 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x00000225C0C263F0, 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 0x00000225C0C27E00, 16 bytes long.
Data: <ÈíÀÀ% > C8 ED C0 C0 25 02 00 00 00 00 00 00 00 00 00 00
{285} normal block at 0x00000225C0C230B0, 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 0x00000225C0C27FE0, 16 bytes long.
Data: < íÀÀ% > A0 ED C0 C0 25 02 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x00000225C0C27DB0, 16 bytes long.
Data: <xíÀÀ% > 78 ED C0 C0 25 02 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x00000225C0C27900, 16 bytes long.
Data: <PíÀÀ% > 50 ED C0 C0 25 02 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x00000225C0C28170, 16 bytes long.
Data: <(íÀÀ% > 28 ED C0 C0 25 02 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x00000225C0C28080, 16 bytes long.
Data: < íÀÀ% > 00 ED C0 C0 25 02 00 00 00 00 00 00 00 00 00 00
{278} normal block at 0x00000225C0C27D60, 16 bytes long.
Data: <ØìÀÀ% > D8 EC C0 C0 25 02 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x00000225C0C22FF0, 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 0x00000225C0C27B80, 16 bytes long.
Data: <°ìÀÀ% > B0 EC C0 C0 25 02 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x00000225C0C0ECB0, 320 bytes long.
Data: < {ÂÀ% ð/ÂÀ% > 80 7B C2 C0 25 02 00 00 F0 2F C2 C0 25 02 00 00
{274} normal block at 0x00000225C0C278B0, 16 bytes long.
Data: <@‡ÂÀ% > 40 87 C2 C0 25 02 00 00 00 00 00 00 00 00 00 00
{273} normal block at 0x00000225C0C27B30, 16 bytes long.
Data: < ‡ÂÀ% > 18 87 C2 C0 25 02 00 00 00 00 00 00 00 00 00 00
{272} normal block at 0x00000225C0C23470, 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 0x00000225C0C27720, 16 bytes long.
Data: <ð†ÂÀ% > F0 86 C2 C0 25 02 00 00 00 00 00 00 00 00 00 00
{270} normal block at 0x00000225C0C22B70, 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 0x00000225C0C27A90, 16 bytes long.
Data: <8†ÂÀ% > 38 86 C2 C0 25 02 00 00 00 00 00 00 00 00 00 00
{268} normal block at 0x00000225C0C27D10, 16 bytes long.
Data: < †ÂÀ% > 10 86 C2 C0 25 02 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x00000225C0C27680, 16 bytes long.
Data: <è…ÂÀ% > E8 85 C2 C0 25 02 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x00000225C0C27C70, 16 bytes long.
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{265} normal block at 0x00000225C0C27860, 16 bytes long.
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{264} normal block at 0x00000225C0C27CC0, 16 bytes long.
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{262} normal block at 0x00000225C0C27EF0, 16 bytes long.
Data: <PaÂÀ% > 50 61 C2 C0 25 02 00 00 00 00 00 00 00 00 00 00
{261} normal block at 0x00000225C0C26150, 40 bytes long.
Data: <ð~ÂÀ% ï Â% > F0 7E C2 C0 25 02 00 00 90 EF 88 C2 25 02 00 00
{260} normal block at 0x00000225C0C27EA0, 16 bytes long.
Data: <P…ÂÀ% > 50 85 C2 C0 25 02 00 00 00 00 00 00 00 00 00 00
{259} normal block at 0x00000225C0C27540, 16 bytes long.
Data: <(…ÂÀ% > 28 85 C2 C0 25 02 00 00 00 00 00 00 00 00 00 00
{258} normal block at 0x00000225C0C22F90, 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 0x00000225C0C27810, 16 bytes long.
Data: < …ÂÀ% > 00 85 C2 C0 25 02 00 00 00 00 00 00 00 00 00 00
{256} normal block at 0x00000225C0C28500, 992 bytes long.
Data: < xÂÀ% /ÂÀ% > 10 78 C2 C0 25 02 00 00 90 2F C2 C0 25 02 00 00
{92} normal block at 0x00000225C0C229F0, 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 0x00000225C0C1FDA0, 16 bytes long.
Data: < `ÂÀ% > 00 60 C2 C0 25 02 00 00 00 00 00 00 00 00 00 00
{90} normal block at 0x00000225C0C26000, 40 bytes long.
Data: < ýÁÀ% ð)ÂÀ% > A0 FD C1 C0 25 02 00 00 F0 29 C2 C0 25 02 00 00
{69} normal block at 0x00000225C0C1F440, 16 bytes long.
Data: < ê÷Ç÷ > 80 EA F7 C7 F7 7F 00 00 00 00 00 00 00 00 00 00
{68} normal block at 0x00000225C0C1F580, 16 bytes long.
Data: <@é÷Ç÷ > 40 E9 F7 C7 F7 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x00000225C0C1F030, 16 bytes long.
Data: <øWôÇ÷ > F8 57 F4 C7 F7 7F 00 00 00 00 00 00 00 00 00 00
{66} normal block at 0x00000225C0C1F620, 16 bytes long.
Data: <ØWôÇ÷ > D8 57 F4 C7 F7 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x00000225C0C1F1C0, 16 bytes long.
Data: <P ôÇ÷ > 50 04 F4 C7 F7 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x00000225C0C1F670, 16 bytes long.
Data: <0 ôÇ÷ > 30 04 F4 C7 F7 7F 00 00 00 00 00 00 00 00 00 00
{63} normal block at 0x00000225C0C1F4E0, 16 bytes long.
Data: <à ôÇ÷ > E0 02 F4 C7 F7 7F 00 00 00 00 00 00 00 00 00 00
{62} normal block at 0x00000225C0C1F8A0, 16 bytes long.
Data: < ôÇ÷ > 10 04 F4 C7 F7 7F 00 00 00 00 00 00 00 00 00 00
{61} normal block at 0x00000225C0C1F8F0, 16 bytes long.
Data: <p ôÇ÷ > 70 04 F4 C7 F7 7F 00 00 00 00 00 00 00 00 00 00
{60} normal block at 0x00000225C0C1F850, 16 bytes long.
Data: < ÀòÇ÷ > 18 C0 F2 C7 F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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