Task 38627248
| Name | cdk8_A10_A17_r0_5-QUICO_ATM_GAFF2_NAGL_cdk8-0-6-RND4700_0 |
| Workunit | 31577253 |
| Created | 24 Apr 2026, 11:37:58 UTC |
| Sent | 24 Apr 2026, 11:59:58 UTC |
| Report deadline | 29 Apr 2026, 11:59:58 UTC |
| Received | 24 Apr 2026, 12:35:30 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 195 (0x000000C3) EXIT_CHILD_FAILED |
| Computer ID | 621753 |
| Run time | 2 min 7 sec |
| CPU time | 28 sec |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 8,092.61 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 620.44 MB |
| Peak swap size | 9.26 GB |
| Peak disk usage | 1.42 GB |
Stderr output
<core_client_version>7.24.1</core_client_version>
<![CDATA[
<message>
- exit code 195 (0xc3)</message>
<stderr_txt>
21:32:05 (6536): wrapper (7.9.26016): starting
21:32:05 (6536): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A10_A17_0.pdb
QB_A10_A17_0.xml
QB_A10_A17.inpcrd
QB_A10_A17_input.yaml
QB_A10_A17.pdb
QB_A10_A17.prmtop
QB_A10_A17_sys.xml
run.bat
run.sh
21:32:08 (6536): Library/usr/bin/tar.exe exited; CPU time 0.000000
21:32:08 (6536): 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 'D:\DOWNLOAD\¿¹Àüµ¥ÀÌÅÍ\BOINCPortable\Data\BOINCPortableData\slots\21\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 'D:\DOWNLOAD\¿¹Àüµ¥ÀÌÅÍ\BOINCPortable\Data\BOINCPortableData\slots\21\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 "D:\DOWNLOAD\¿¹Àüµ¥ÀÌÅÍ\BOINCPortable\Data\BOINCPortableData\slots\21\Scripts\rbfe_production.exe\__main__.py", line 7, in <module>
File "D:\DOWNLOAD\¿¹Àüµ¥ÀÌÅÍ\BOINCPortable\Data\BOINCPortableData\slots\21\Lib\site-packages\atom_openmm\rbfe_production.py", line 29, in rbfe_production
rx = openmm_job_RBFE(
^^^^^^^^^^^^^^^^
File "D:\DOWNLOAD\¿¹Àüµ¥ÀÌÅÍ\BOINCPortable\Data\BOINCPortableData\slots\21\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 "D:\DOWNLOAD\¿¹Àüµ¥ÀÌÅÍ\BOINCPortable\Data\BOINCPortableData\slots\21\Lib\site-packages\atom_openmm\ommworker.py", line 53, in __init__
self.start_worker()
File "D:\DOWNLOAD\¿¹Àüµ¥ÀÌÅÍ\BOINCPortable\Data\BOINCPortableData\slots\21\Lib\site-packages\atom_openmm\ommworker.py", line 444, in start_worker
self._openmm_worker_makecontext()
File "D:\DOWNLOAD\¿¹Àüµ¥ÀÌÅÍ\BOINCPortable\Data\BOINCPortableData\slots\21\Lib\site-packages\atom_openmm\ommworker.py", line 229, in _openmm_worker_makecontext
self.platform = Platform.getPlatformByName(self.platform_name)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "D:\DOWNLOAD\¿¹Àüµ¥ÀÌÅÍ\BOINCPortable\Data\BOINCPortableData\slots\21\Lib\site-packages\openmm\openmm.py", line 17238, in getPlatformByName
return _openmm.Platform_getPlatformByName(name)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
openmm.OpenMMException: There is no registered Platform called "CUDA"
21:33:05 (6536): C:/Windows/system32/cmd.exe exited; CPU time 39.203125
21:33:05 (6536): app exit status: 0x16
21:33:05 (6536): called boinc_finish(195)
0 bytes in 0 Free Blocks.
744 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: 1511823 bytes.
Dumping objects ->
{3836065} normal block at 0x000001D9470E3790, 96 bytes long.
Data: <PATH=D:\DOWNLOAD> 50 41 54 48 3D 44 3A 5C 44 4F 57 4E 4C 4F 41 44
{3836054} normal block at 0x000001D944FE6770, 80 bytes long.
Data: <HOME=D:\DOWNLOAD> 48 4F 4D 45 3D 44 3A 5C 44 4F 57 4E 4C 4F 41 44
{3836043} normal block at 0x000001D944FE58D0, 80 bytes long.
Data: <TMP=D:\DOWNLOAD\> 54 4D 50 3D 44 3A 5C 44 4F 57 4E 4C 4F 41 44 5C
{3836032} normal block at 0x000001D944FE62F0, 80 bytes long.
Data: <TEMP=D:\DOWNLOAD> 54 45 4D 50 3D 44 3A 5C 44 4F 57 4E 4C 4F 41 44
{3836021} normal block at 0x000001D944FE5450, 80 bytes long.
Data: <TMPDIR=D:\DOWNLO> 54 4D 50 44 49 52 3D 44 3A 5C 44 4F 57 4E 4C 4F
{3835990} normal block at 0x000001D9470E49B0, 96 bytes long.
Data: <PATH=D:\DOWNLOAD> 50 41 54 48 3D 44 3A 5C 44 4F 57 4E 4C 4F 41 44
{3835979} normal block at 0x000001D945018E70, 140 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) : {3835976} normal block at 0x000001D944FBF4B0, 8 bytes long.
Data: < D > 00 00 F8 44 D9 01 00 00
{3835180} normal block at 0x000001D9450183E0, 140 bytes long.
Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65
{3834409} normal block at 0x000001D944FBF140, 8 bytes long.
Data: < D > C0 10 FA 44 D9 01 00 00
..\zip\boinc_zip.cpp(122) : {400} normal block at 0x000001D944FA5660, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{385} normal block at 0x000001D944FA5CA0, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
{384} normal block at 0x000001D944FBF5A0, 16 bytes long.
Data: < D > C8 E8 FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{383} normal block at 0x000001D944FBF1E0, 16 bytes long.
Data: < D > A0 E8 FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{382} normal block at 0x000001D944FB5DC0, 32 bytes long.
Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D
{381} normal block at 0x000001D944FBAF00, 16 bytes long.
Data: <x D > 78 E8 FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{380} normal block at 0x000001D944FBB950, 16 bytes long.
Data: <P D > 50 E8 FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{379} normal block at 0x000001D944FBBBD0, 16 bytes long.
Data: <( D > 28 E8 FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{378} normal block at 0x000001D944FBB310, 16 bytes long.
Data: < D > 00 E8 FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{377} normal block at 0x000001D944FB6FC0, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{376} normal block at 0x000001D944FBB4A0, 16 bytes long.
Data: < D > F8 9C FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{375} normal block at 0x000001D944FB55E0, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{374} normal block at 0x000001D944FBB900, 16 bytes long.
Data: < D > D0 9C FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{372} normal block at 0x000001D944FBAE10, 16 bytes long.
Data: < D > A8 9C FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{371} normal block at 0x000001D944FBB090, 16 bytes long.
Data: < D > 80 9C FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{370} normal block at 0x000001D944FBB720, 16 bytes long.
Data: <X D > 58 9C FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{369} normal block at 0x000001D944FBB270, 16 bytes long.
Data: <0 D > 30 9C FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{368} normal block at 0x000001D944FBBB30, 16 bytes long.
Data: < D > 08 9C FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{367} normal block at 0x000001D944FB5580, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{366} normal block at 0x000001D944FBB040, 16 bytes long.
Data: < D > E0 9B FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{365} normal block at 0x000001D944FB9BE0, 320 bytes long.
Data: <@ D U D > 40 B0 FB 44 D9 01 00 00 80 55 FB 44 D9 01 00 00
{364} normal block at 0x000001D944FBB810, 16 bytes long.
Data: < D > E0 E7 FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{363} normal block at 0x000001D944FBB630, 16 bytes long.
Data: < D > B8 E7 FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{362} normal block at 0x000001D944FB5520, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{361} normal block at 0x000001D944FBB860, 16 bytes long.
Data: < D > 90 E7 FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{360} normal block at 0x000001D944FB59A0, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{359} normal block at 0x000001D944FBB770, 16 bytes long.
Data: < D > D8 E6 FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{358} normal block at 0x000001D944FBB6D0, 16 bytes long.
Data: < D > B0 E6 FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{357} normal block at 0x000001D944FBB9A0, 16 bytes long.
Data: < D > 88 E6 FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{356} normal block at 0x000001D944FBB680, 16 bytes long.
Data: <` D > 60 E6 FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{355} normal block at 0x000001D944FBAF50, 16 bytes long.
Data: <8 D > 38 E6 FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{354} normal block at 0x000001D944FBBB80, 16 bytes long.
Data: < D > 10 E6 FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{352} normal block at 0x000001D944FBB400, 16 bytes long.
Data: <Pv D > 50 76 FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{351} normal block at 0x000001D944FB7650, 40 bytes long.
Data: < D I G > 00 B4 FB 44 D9 01 00 00 B0 49 0E 47 D9 01 00 00
{350} normal block at 0x000001D944FBB4F0, 16 bytes long.
Data: < D > F0 E5 FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{349} normal block at 0x000001D944FBAEB0, 16 bytes long.
Data: < D > C8 E5 FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{348} normal block at 0x000001D944FB5220, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{347} normal block at 0x000001D944FBBAE0, 16 bytes long.
Data: < D > A0 E5 FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{346} normal block at 0x000001D944FBE5A0, 992 bytes long.
Data: < D R D > E0 BA FB 44 D9 01 00 00 20 52 FB 44 D9 01 00 00
{182} normal block at 0x000001D944FB5280, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{181} normal block at 0x000001D944FBB220, 16 bytes long.
Data: <p| D > 70 7C FB 44 D9 01 00 00 00 00 00 00 00 00 00 00
{180} normal block at 0x000001D944FB7C70, 40 bytes long.
Data: < D R D > 20 B2 FB 44 D9 01 00 00 80 52 FB 44 D9 01 00 00
{157} normal block at 0x000001D944FBAFA0, 16 bytes long.
Data: < > 80 EA 17 18 F7 7F 00 00 00 00 00 00 00 00 00 00
{156} normal block at 0x000001D944FBB2C0, 16 bytes long.
Data: <@ > 40 E9 17 18 F7 7F 00 00 00 00 00 00 00 00 00 00
{155} normal block at 0x000001D944FBBC20, 16 bytes long.
Data: < W > F8 57 14 18 F7 7F 00 00 00 00 00 00 00 00 00 00
{154} normal block at 0x000001D944FBAD70, 16 bytes long.
Data: < W > D8 57 14 18 F7 7F 00 00 00 00 00 00 00 00 00 00
{153} normal block at 0x000001D944FAAA80, 16 bytes long.
Data: <P > 50 04 14 18 F7 7F 00 00 00 00 00 00 00 00 00 00
{152} normal block at 0x000001D944FAA9E0, 16 bytes long.
Data: <0 > 30 04 14 18 F7 7F 00 00 00 00 00 00 00 00 00 00
{151} normal block at 0x000001D944FAA710, 16 bytes long.
Data: < > E0 02 14 18 F7 7F 00 00 00 00 00 00 00 00 00 00
{150} normal block at 0x000001D944FAA6C0, 16 bytes long.
Data: < > 10 04 14 18 F7 7F 00 00 00 00 00 00 00 00 00 00
{149} normal block at 0x000001D944FAA620, 16 bytes long.
Data: <p > 70 04 14 18 F7 7F 00 00 00 00 00 00 00 00 00 00
{148} normal block at 0x000001D944FAA7B0, 16 bytes long.
Data: < > 18 C0 12 18 F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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