Task 38618027
| Name | hif2a_A39_A21_r0_1-QUICO_ATM_GAFF2_NAGL_hif2a-1-6-RND9252_0 |
| Workunit | 31569585 |
| Created | 18 Apr 2026, 9:17:09 UTC |
| Sent | 18 Apr 2026, 9:17:14 UTC |
| Report deadline | 23 Apr 2026, 9:17:14 UTC |
| Received | 18 Apr 2026, 9:25:31 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 195 (0x000000C3) EXIT_CHILD_FAILED |
| Computer ID | 652138 |
| Run time | 1 min 35 sec |
| CPU time | 13 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 | 196.06 MB |
| Peak swap size | 10.34 GB |
| Peak disk usage | 3.08 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>
18:22:49 (14044): wrapper (7.9.26016): starting
18:22:49 (14044): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A39_A21_0.pdb
QB_A39_A21_0.xml
QB_A39_A21.inpcrd
QB_A39_A21_input.yaml
QB_A39_A21.pdb
QB_A39_A21.prmtop
QB_A39_A21_sys.xml
run.bat
run.sh
18:22:50 (14044): Library/usr/bin/tar.exe exited; CPU time 0.000000
18:22:50 (14044): 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"
18:23:28 (14044): C:/Windows/system32/cmd.exe exited; CPU time 13.265625
18:23:28 (14044): app exit status: 0x16
18:23:28 (14044): 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: 675531 bytes.
Dumping objects ->
{3835376} normal block at 0x00000144D41212C0, 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 0x00000144D4120D80, 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 0x00000144D4120D10, 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 0x00000144D4120CA0, 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 0x00000144D4121480, 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 0x00000144D426A9E0, 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 0x00000144D21DD6A0, 8 bytes long.
Data: < ÒD > 00 00 18 D2 44 01 00 00
{3834045} normal block at 0x00000144D21DDE20, 8 bytes long.
Data: < x ÔD > F0 78 1C D4 44 01 00 00
..\zip\boinc_zip.cpp(122) : {309} normal block at 0x00000144D21D7A40, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{294} normal block at 0x00000144D21D62E0, 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 0x00000144D21E9270, 16 bytes long.
Data: <È£ ÒD > C8 A3 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x00000144D21E96D0, 16 bytes long.
Data: < £ ÒD > A0 A3 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{291} normal block at 0x00000144D21E5D90, 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 0x00000144D21E9680, 16 bytes long.
Data: <x£ ÒD > 78 A3 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x00000144D21E9950, 16 bytes long.
Data: <P£ ÒD > 50 A3 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{288} normal block at 0x00000144D21E9220, 16 bytes long.
Data: <(£ ÒD > 28 A3 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x00000144D21E9900, 16 bytes long.
Data: < £ ÒD > 00 A3 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{286} normal block at 0x00000144D21E38A0, 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 0x00000144D21E91D0, 16 bytes long.
Data: < L ÒD > 18 4C 1D D2 44 01 00 00 00 00 00 00 00 00 00 00
{284} normal block at 0x00000144D21E5310, 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 0x00000144D21E9AE0, 16 bytes long.
Data: < K ÒD > F0 4B 1D D2 44 01 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x00000144D21E9630, 16 bytes long.
Data: <ÈK ÒD > C8 4B 1D D2 44 01 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x00000144D21E9400, 16 bytes long.
Data: < K ÒD > A0 4B 1D D2 44 01 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x00000144D21E92C0, 16 bytes long.
Data: <xK ÒD > 78 4B 1D D2 44 01 00 00 00 00 00 00 00 00 00 00
{278} normal block at 0x00000144D21E9A40, 16 bytes long.
Data: <PK ÒD > 50 4B 1D D2 44 01 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x00000144D21E9FE0, 16 bytes long.
Data: <(K ÒD > 28 4B 1D D2 44 01 00 00 00 00 00 00 00 00 00 00
{276} normal block at 0x00000144D21E5C10, 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 0x00000144D21E9F90, 16 bytes long.
Data: < K ÒD > 00 4B 1D D2 44 01 00 00 00 00 00 00 00 00 00 00
{274} normal block at 0x00000144D21D4B00, 320 bytes long.
Data: < ÒD \ ÒD > 90 9F 1E D2 44 01 00 00 10 5C 1E D2 44 01 00 00
{273} normal block at 0x00000144D21E9E50, 16 bytes long.
Data: < ¢ ÒD > E0 A2 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{272} normal block at 0x00000144D21E9130, 16 bytes long.
Data: <¸¢ ÒD > B8 A2 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{271} normal block at 0x00000144D21E5430, 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 0x00000144D21E9DB0, 16 bytes long.
Data: < ¢ ÒD > 90 A2 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{269} normal block at 0x00000144D21E5E50, 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 0x00000144D21E99A0, 16 bytes long.
Data: <Ø¡ ÒD > D8 A1 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x00000144D21E9D10, 16 bytes long.
Data: <°¡ ÒD > B0 A1 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x00000144D21E9860, 16 bytes long.
Data: < ¡ ÒD > 88 A1 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{265} normal block at 0x00000144D21E9C70, 16 bytes long.
Data: <`¡ ÒD > 60 A1 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{264} normal block at 0x00000144D21E99F0, 16 bytes long.
Data: <8¡ ÒD > 38 A1 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{263} normal block at 0x00000144D21E90E0, 16 bytes long.
Data: < ¡ ÒD > 10 A1 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{261} normal block at 0x00000144D21E9E00, 16 bytes long.
Data: < 6 ÒD > E0 36 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{260} normal block at 0x00000144D21E36E0, 40 bytes long.
Data: < ÒD ©&ÔD > 00 9E 1E D2 44 01 00 00 E0 A9 26 D4 44 01 00 00
{259} normal block at 0x00000144D21E9EA0, 16 bytes long.
Data: < ÒD > F0 A0 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{258} normal block at 0x00000144D21E9CC0, 16 bytes long.
Data: <È ÒD > C8 A0 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{257} normal block at 0x00000144D21E5BB0, 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 0x00000144D21E95E0, 16 bytes long.
Data: < ÒD > A0 A0 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{255} normal block at 0x00000144D21EA0A0, 992 bytes long.
Data: < ÒD °[ ÒD > E0 95 1E D2 44 01 00 00 B0 5B 1E D2 44 01 00 00
{91} normal block at 0x00000144D21E54F0, 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 0x00000144D21DD2E0, 16 bytes long.
Data: < 9 ÒD > F0 39 1E D2 44 01 00 00 00 00 00 00 00 00 00 00
{89} normal block at 0x00000144D21E39F0, 40 bytes long.
Data: < Ò ÒD T ÒD > E0 D2 1D D2 44 01 00 00 F0 54 1E D2 44 01 00 00
{66} normal block at 0x00000144D21DD150, 16 bytes long.
Data: < O > 80 EA 8D 4F F7 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x00000144D21DD0B0, 16 bytes long.
Data: <@ O > 40 E9 8D 4F F7 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x00000144D21DDDD0, 16 bytes long.
Data: < W O > F8 57 8A 4F F7 7F 00 00 00 00 00 00 00 00 00 00
{63} normal block at 0x00000144D21DD560, 16 bytes long.
Data: <ØW O > D8 57 8A 4F F7 7F 00 00 00 00 00 00 00 00 00 00
{62} normal block at 0x00000144D21DD1F0, 16 bytes long.
Data: <P O > 50 04 8A 4F F7 7F 00 00 00 00 00 00 00 00 00 00
{61} normal block at 0x00000144D21DD330, 16 bytes long.
Data: <0 O > 30 04 8A 4F F7 7F 00 00 00 00 00 00 00 00 00 00
{60} normal block at 0x00000144D21DDBA0, 16 bytes long.
Data: < O > E0 02 8A 4F F7 7F 00 00 00 00 00 00 00 00 00 00
{59} normal block at 0x00000144D21DD380, 16 bytes long.
Data: < O > 10 04 8A 4F F7 7F 00 00 00 00 00 00 00 00 00 00
{58} normal block at 0x00000144D21DD470, 16 bytes long.
Data: <p O > 70 04 8A 4F F7 7F 00 00 00 00 00 00 00 00 00 00
{57} normal block at 0x00000144D21DD7E0, 16 bytes long.
Data: < À O > 18 C0 88 4F F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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