Task 38617414
| Name | p38_2_A27_A17_r0_1-QUICO_ATM_OpenFF_NAGL_p38_2-2-6-RND5988_0 |
| Workunit | 31569083 |
| Created | 18 Apr 2026, 4:12:10 UTC |
| Sent | 18 Apr 2026, 4:12:23 UTC |
| Report deadline | 23 Apr 2026, 4:12:23 UTC |
| Received | 18 Apr 2026, 4:26:51 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 195 (0x000000C3) EXIT_CHILD_FAILED |
| Computer ID | 652138 |
| Run time | 2 min 4 sec |
| CPU time | 36 sec |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 22,071.43 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 399.11 MB |
| Peak swap size | 10.55 GB |
| Peak disk usage | 1.58 GB |
Stderr output
<core_client_version>8.2.4</core_client_version>
<![CDATA[
<message>
���̃I�y���[�e�B���O �V�X�e���ł� (null) �͎��s����܂���B
(0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
13:24:17 (36264): wrapper (7.9.26016): starting
13:24:17 (36264): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A27_A17_0.pdb
QB_A27_A17_0.xml
QB_A27_A17.inpcrd
QB_A27_A17_input.yaml
QB_A27_A17.pdb
QB_A27_A17.prmtop
QB_A27_A17_sys.xml
run.bat
run.sh
13:24:18 (36264): Library/usr/bin/tar.exe exited; CPU time 0.000000
13:24:18 (36264): 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 'F:\BOINC\BOINCƒf[ƒ^\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 'F:\BOINC\BOINCƒf[ƒ^\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 "F:\BOINC\BOINCƒf[ƒ^\slots\1\Scripts\rbfe_production.exe\__main__.py", line 7, in <module>
File "F:\BOINC\BOINCƒf[ƒ^\slots\1\Lib\site-packages\atom_openmm\rbfe_production.py", line 29, in rbfe_production
rx = openmm_job_RBFE(
^^^^^^^^^^^^^^^^
File "F:\BOINC\BOINCƒf[ƒ^\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 "F:\BOINC\BOINCƒf[ƒ^\slots\1\Lib\site-packages\atom_openmm\ommworker.py", line 53, in __init__
self.start_worker()
File "F:\BOINC\BOINCƒf[ƒ^\slots\1\Lib\site-packages\atom_openmm\ommworker.py", line 444, in start_worker
self._openmm_worker_makecontext()
File "F:\BOINC\BOINCƒf[ƒ^\slots\1\Lib\site-packages\atom_openmm\ommworker.py", line 229, in _openmm_worker_makecontext
self.platform = Platform.getPlatformByName(self.platform_name)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "F:\BOINC\BOINCƒf[ƒ^\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"
13:25:24 (36264): C:/Windows/system32/cmd.exe exited; CPU time 36.265625
13:25:24 (36264): app exit status: 0x16
13:25:24 (36264): 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: 1526573 bytes.
Dumping objects ->
{3835376} normal block at 0x000002E607DF0FB0, 48 bytes long.
Data: <PATH=F:\BOINC\BO> 50 41 54 48 3D 46 3A 5C 42 4F 49 4E 43 5C 42 4F
{3835365} normal block at 0x000002E607DF1100, 48 bytes long.
Data: <HOME=F:\BOINC\BO> 48 4F 4D 45 3D 46 3A 5C 42 4F 49 4E 43 5C 42 4F
{3835354} normal block at 0x000002E607DF1020, 48 bytes long.
Data: <TMP=F:\BOINC\BOI> 54 4D 50 3D 46 3A 5C 42 4F 49 4E 43 5C 42 4F 49
{3835343} normal block at 0x000002E607DF08B0, 48 bytes long.
Data: <TEMP=F:\BOINC\BO> 54 45 4D 50 3D 46 3A 5C 42 4F 49 4E 43 5C 42 4F
{3835332} normal block at 0x000002E607DF1330, 48 bytes long.
Data: <TMPDIR=F:\BOINC\> 54 4D 50 44 49 52 3D 46 3A 5C 42 4F 49 4E 43 5C
{3835301} normal block at 0x000002E607F39E60, 64 bytes long.
Data: <PATH=F:\BOINC\BO> 50 41 54 48 3D 46 3A 5C 42 4F 49 4E 43 5C 42 4F
..\api\boinc_api.cpp(309) : {3835288} normal block at 0x000002E605DCD6F0, 8 bytes long.
Data: < > 00 00 87 07 E6 02 00 00
{3834045} normal block at 0x000002E605DCDEC0, 8 bytes long.
Data: < x > F0 78 E9 07 E6 02 00 00
..\zip\boinc_zip.cpp(122) : {309} normal block at 0x000002E605DC6F00, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{294} normal block at 0x000002E605DC5B90, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
{293} normal block at 0x000002E605DD90E0, 16 bytes long.
Data: <È£Ý > C8 A3 DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x000002E605DDA030, 16 bytes long.
Data: < £Ý > A0 A3 DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{291} normal block at 0x000002E605DD5610, 32 bytes long.
Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D
{290} normal block at 0x000002E605DD9AE0, 16 bytes long.
Data: <x£Ý > 78 A3 DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x000002E605DD99F0, 16 bytes long.
Data: <P£Ý > 50 A3 DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{288} normal block at 0x000002E605DD9B80, 16 bytes long.
Data: <(£Ý > 28 A3 DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x000002E605DD9590, 16 bytes long.
Data: < £Ý > 00 A3 DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{286} normal block at 0x000002E605DD38A0, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{285} normal block at 0x000002E605DD99A0, 16 bytes long.
Data: <xMÜ > 78 4D DC 05 E6 02 00 00 00 00 00 00 00 00 00 00
{284} normal block at 0x000002E605DD5730, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{283} normal block at 0x000002E605DD9860, 16 bytes long.
Data: <PMÜ > 50 4D DC 05 E6 02 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x000002E605DD9D60, 16 bytes long.
Data: <(MÜ > 28 4D DC 05 E6 02 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x000002E605DD9FE0, 16 bytes long.
Data: < MÜ > 00 4D DC 05 E6 02 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x000002E605DD9540, 16 bytes long.
Data: <ØLÜ > D8 4C DC 05 E6 02 00 00 00 00 00 00 00 00 00 00
{278} normal block at 0x000002E605DD9810, 16 bytes long.
Data: <°LÜ > B0 4C DC 05 E6 02 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x000002E605DD9F90, 16 bytes long.
Data: < LÜ > 88 4C DC 05 E6 02 00 00 00 00 00 00 00 00 00 00
{276} normal block at 0x000002E605DD5A30, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{275} normal block at 0x000002E605DD9270, 16 bytes long.
Data: <`LÜ > 60 4C DC 05 E6 02 00 00 00 00 00 00 00 00 00 00
{274} normal block at 0x000002E605DC4C60, 320 bytes long.
Data: <p Ý 0ZÝ > 70 92 DD 05 E6 02 00 00 30 5A DD 05 E6 02 00 00
{273} normal block at 0x000002E605DD9D10, 16 bytes long.
Data: < ¢Ý > E0 A2 DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{272} normal block at 0x000002E605DD9F40, 16 bytes long.
Data: <¸¢Ý > B8 A2 DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{271} normal block at 0x000002E605DD51F0, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{270} normal block at 0x000002E605DD9A90, 16 bytes long.
Data: < ¢Ý > 90 A2 DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{269} normal block at 0x000002E605DD5C70, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{268} normal block at 0x000002E605DD9A40, 16 bytes long.
Data: <Ø¡Ý > D8 A1 DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x000002E605DD9EF0, 16 bytes long.
Data: <°¡Ý > B0 A1 DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x000002E605DD9310, 16 bytes long.
Data: < ¡Ý > 88 A1 DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{265} normal block at 0x000002E605DD9CC0, 16 bytes long.
Data: <`¡Ý > 60 A1 DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{264} normal block at 0x000002E605DD9220, 16 bytes long.
Data: <8¡Ý > 38 A1 DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{263} normal block at 0x000002E605DD97C0, 16 bytes long.
Data: < ¡Ý > 10 A1 DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{261} normal block at 0x000002E605DD9950, 16 bytes long.
Data: <p=Ý > 70 3D DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{260} normal block at 0x000002E605DD3D70, 40 bytes long.
Data: <P Ý ` > 50 99 DD 05 E6 02 00 00 60 9E F3 07 E6 02 00 00
{259} normal block at 0x000002E605DD9720, 16 bytes long.
Data: < Ý > F0 A0 DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{258} normal block at 0x000002E605DD9C70, 16 bytes long.
Data: <È Ý > C8 A0 DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{257} normal block at 0x000002E605DD56D0, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{256} normal block at 0x000002E605DD92C0, 16 bytes long.
Data: < Ý > A0 A0 DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{255} normal block at 0x000002E605DDA0A0, 992 bytes long.
Data: <À Ý ÐVÝ > C0 92 DD 05 E6 02 00 00 D0 56 DD 05 E6 02 00 00
{91} normal block at 0x000002E605DD5070, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{90} normal block at 0x000002E605DCD8D0, 16 bytes long.
Data: < 9Ý > 10 39 DD 05 E6 02 00 00 00 00 00 00 00 00 00 00
{89} normal block at 0x000002E605DD3910, 40 bytes long.
Data: <ÐØÜ pPÝ > D0 D8 DC 05 E6 02 00 00 70 50 DD 05 E6 02 00 00
{66} normal block at 0x000002E605DCD150, 16 bytes long.
Data: < > 80 EA F5 0E F6 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x000002E605DCD380, 16 bytes long.
Data: <@ > 40 E9 F5 0E F6 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x000002E605DCD6A0, 16 bytes long.
Data: < W > F8 57 F2 0E F6 7F 00 00 00 00 00 00 00 00 00 00
{63} normal block at 0x000002E605DCD650, 16 bytes long.
Data: <ØW > D8 57 F2 0E F6 7F 00 00 00 00 00 00 00 00 00 00
{62} normal block at 0x000002E605DCDB00, 16 bytes long.
Data: <P > 50 04 F2 0E F6 7F 00 00 00 00 00 00 00 00 00 00
{61} normal block at 0x000002E605DCD920, 16 bytes long.
Data: <0 > 30 04 F2 0E F6 7F 00 00 00 00 00 00 00 00 00 00
{60} normal block at 0x000002E605DCD330, 16 bytes long.
Data: < > E0 02 F2 0E F6 7F 00 00 00 00 00 00 00 00 00 00
{59} normal block at 0x000002E605DCD290, 16 bytes long.
Data: < > 10 04 F2 0E F6 7F 00 00 00 00 00 00 00 00 00 00
{58} normal block at 0x000002E605DCD560, 16 bytes long.
Data: <p > 70 04 F2 0E F6 7F 00 00 00 00 00 00 00 00 00 00
{57} normal block at 0x000002E605DCD510, 16 bytes long.
Data: < À > 18 C0 F0 0E F6 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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