Task 38681534
| Name | test_636-GPUGRID_TEST_ATM_40STEP_20261023-32-40-RND3366_0 |
| Workunit | 31623196 |
| Created | 27 Oct 2026, 4:22:41 UTC |
| Sent | 27 Oct 2026, 4:22:50 UTC |
| Report deadline | 1 Nov 2026, 4:22:50 UTC |
| Received | 27 Oct 2026, 5:44:55 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 195 (0x000000C3) EXIT_CHILD_FAILED |
| Computer ID | 628418 |
| Run time | 31 min 1 sec |
| CPU time | 30 min 43 sec |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 13,171.24 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 700.24 MB |
| Peak swap size | 9.86 GB |
| Peak disk usage | 3.91 GB |
Stderr output
<core_client_version>8.2.8</core_client_version>
<![CDATA[
<message>
The operating system cannot run (null).
(0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
05:13:15 (13012): wrapper (7.9.26016): starting
05:13:15 (13012): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A34_A12_0.pdb
QB_A34_A12_0.xml
QB_A34_A12_input.yaml
QB_A34_A12.pdb
QB_A34_A12.prmtop
QB_A34_A12_sys.xml
run.bat
run.sh
05:13:16 (13012): Library/usr/bin/tar.exe exited; CPU time 0.000000
05:13:16 (13012): 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:\BOINC_DATA\slots\0\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:\BOINC_DATA\slots\0\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:\BOINC_DATA\slots\0\Scripts\rbfe_production.exe\__main__.py", line 7, in <module>
File "D:\BOINC_DATA\slots\0\Lib\site-packages\atom_openmm\rbfe_production.py", line 33, in rbfe_production
rx.scheduleJobs()
File "D:\BOINC_DATA\slots\0\Lib\site-packages\atom_openmm\async_re.py", line 321, in scheduleJobs
self.transport.ProcessJobQueue(min_time,cycle_time)
File "D:\BOINC_DATA\slots\0\Lib\site-packages\atom_openmm\local_openmm_transport.py", line 186, in ProcessJobQueue
self.isDone(repl,0)
File "D:\BOINC_DATA\slots\0\Lib\site-packages\atom_openmm\local_openmm_transport.py", line 287, in isDone
retcode = self._update_replica(job)
^^^^^^^^^^^^^^^^^^^^^^^^^
File "D:\BOINC_DATA\slots\0\Lib\site-packages\atom_openmm\local_openmm_transport.py", line 210, in _update_replica
(pos,vel) = job['openmm_worker'].get_posvel()
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "D:\BOINC_DATA\slots\0\Lib\site-packages\atom_openmm\ommworker.py", line 467, in get_posvel
state = self.context.getState(getPositions=True, getVelocities=True)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "D:\BOINC_DATA\slots\0\Lib\site-packages\openmm\openmm.py", line 5022, in getState
state = _openmm.Context_getState(self, types, enforcePeriodicBox, groups_mask)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
openmm.OpenMMException: bad allocation
05:43:09 (13012): C:/Windows/system32/cmd.exe exited; CPU time 1843.703125
05:43:09 (13012): app exit status: 0x16
05:43:09 (13012): called boinc_finish(195)
0 bytes in 0 Free Blocks.
536 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: 30272539 bytes.
Dumping objects ->
{3835248} normal block at 0x000001EE28F515D0, 48 bytes long.
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{3835237} normal block at 0x000001EE290954C0, 32 bytes long.
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{3835226} normal block at 0x000001EE29095640, 32 bytes long.
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{3835215} normal block at 0x000001EE29095580, 32 bytes long.
Data: <TEMP=D:\BOINC_DA> 54 45 4D 50 3D 44 3A 5C 42 4F 49 4E 43 5F 44 41
{3835204} normal block at 0x000001EE29095A60, 32 bytes long.
Data: <TMPDIR=D:\BOINC_> 54 4D 50 44 49 52 3D 44 3A 5C 42 4F 49 4E 43 5F
{3835173} normal block at 0x000001EE28F51100, 48 bytes long.
Data: <PATH=D:\BOINC_DA> 50 41 54 48 3D 44 3A 5C 42 4F 49 4E 43 5F 44 41
{3835162} normal block at 0x000001EE28F5EB50, 180 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) : {3835159} normal block at 0x000001EE27278680, 8 bytes long.
Data: < %'î > 00 00 25 27 EE 01 00 00
{3834561} normal block at 0x000001EE28F5E100, 180 bytes long.
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{3833965} normal block at 0x000001EE272783B0, 8 bytes long.
Data: <p" )î > 70 22 0A 29 EE 01 00 00
..\zip\boinc_zip.cpp(122) : {314} normal block at 0x000001EE2727E070, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
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Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
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{297} normal block at 0x000001EE27283C30, 16 bytes long.
Data: <ðN('î > F0 4E 28 27 EE 01 00 00 00 00 00 00 00 00 00 00
{296} normal block at 0x000001EE2727CFD0, 32 bytes long.
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{295} normal block at 0x000001EE27284B80, 16 bytes long.
Data: <ÈN('î > C8 4E 28 27 EE 01 00 00 00 00 00 00 00 00 00 00
{294} normal block at 0x000001EE27284630, 16 bytes long.
Data: < N('î > A0 4E 28 27 EE 01 00 00 00 00 00 00 00 00 00 00
{293} normal block at 0x000001EE272841D0, 16 bytes long.
Data: <xN('î > 78 4E 28 27 EE 01 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x000001EE27284B30, 16 bytes long.
Data: <PN('î > 50 4E 28 27 EE 01 00 00 00 00 00 00 00 00 00 00
{291} normal block at 0x000001EE2727E7F0, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{290} normal block at 0x000001EE27284540, 16 bytes long.
Data: < À&'î > 98 C0 26 27 EE 01 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x000001EE2727D150, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{288} normal block at 0x000001EE27284680, 16 bytes long.
Data: <pÀ&'î > 70 C0 26 27 EE 01 00 00 00 00 00 00 00 00 00 00
{286} normal block at 0x000001EE27284590, 16 bytes long.
Data: <HÀ&'î > 48 C0 26 27 EE 01 00 00 00 00 00 00 00 00 00 00
{285} normal block at 0x000001EE27283D70, 16 bytes long.
Data: < À&'î > 20 C0 26 27 EE 01 00 00 00 00 00 00 00 00 00 00
{284} normal block at 0x000001EE272844F0, 16 bytes long.
Data: <ø¿&'î > F8 BF 26 27 EE 01 00 00 00 00 00 00 00 00 00 00
{283} normal block at 0x000001EE27284310, 16 bytes long.
Data: <п&'î > D0 BF 26 27 EE 01 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x000001EE272846D0, 16 bytes long.
Data: <¨¿&'î > A8 BF 26 27 EE 01 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x000001EE2727C7F0, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{280} normal block at 0x000001EE27284AE0, 16 bytes long.
Data: < ¿&'î > 80 BF 26 27 EE 01 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x000001EE2726BF80, 320 bytes long.
Data: <àJ('î ðÇ''î > E0 4A 28 27 EE 01 00 00 F0 C7 27 27 EE 01 00 00
{278} normal block at 0x000001EE27284A90, 16 bytes long.
Data: <0N('î > 30 4E 28 27 EE 01 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x000001EE27284A40, 16 bytes long.
Data: < N('î > 08 4E 28 27 EE 01 00 00 00 00 00 00 00 00 00 00
{276} normal block at 0x000001EE2727D510, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{275} normal block at 0x000001EE27284040, 16 bytes long.
Data: <àM('î > E0 4D 28 27 EE 01 00 00 00 00 00 00 00 00 00 00
{274} normal block at 0x000001EE2727CEB0, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{273} normal block at 0x000001EE272847C0, 16 bytes long.
Data: <(M('î > 28 4D 28 27 EE 01 00 00 00 00 00 00 00 00 00 00
{272} normal block at 0x000001EE272844A0, 16 bytes long.
Data: < M('î > 00 4D 28 27 EE 01 00 00 00 00 00 00 00 00 00 00
{271} normal block at 0x000001EE27283F00, 16 bytes long.
Data: <ØL('î > D8 4C 28 27 EE 01 00 00 00 00 00 00 00 00 00 00
{270} normal block at 0x000001EE27284900, 16 bytes long.
Data: <°L('î > B0 4C 28 27 EE 01 00 00 00 00 00 00 00 00 00 00
{269} normal block at 0x000001EE27284950, 16 bytes long.
Data: < L('î > 88 4C 28 27 EE 01 00 00 00 00 00 00 00 00 00 00
{268} normal block at 0x000001EE27283EB0, 16 bytes long.
Data: <`L('î > 60 4C 28 27 EE 01 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x000001EE272849A0, 16 bytes long.
Data: <Àå''î > C0 E5 27 27 EE 01 00 00 00 00 00 00 00 00 00 00
{265} normal block at 0x000001EE2727E5C0, 40 bytes long.
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{264} normal block at 0x000001EE27283E60, 16 bytes long.
Data: <@L('î > 40 4C 28 27 EE 01 00 00 00 00 00 00 00 00 00 00
{263} normal block at 0x000001EE27283FA0, 16 bytes long.
Data: < L('î > 18 4C 28 27 EE 01 00 00 00 00 00 00 00 00 00 00
{262} normal block at 0x000001EE2727CD90, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{261} normal block at 0x000001EE27284770, 16 bytes long.
Data: <ðK('î > F0 4B 28 27 EE 01 00 00 00 00 00 00 00 00 00 00
{260} normal block at 0x000001EE27284BF0, 992 bytes long.
Data: <pG('î Í''î > 70 47 28 27 EE 01 00 00 90 CD 27 27 EE 01 00 00
{96} normal block at 0x000001EE2727D090, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{95} normal block at 0x000001EE27277910, 16 bytes long.
Data: <àä''î > E0 E4 27 27 EE 01 00 00 00 00 00 00 00 00 00 00
{94} normal block at 0x000001EE2727E4E0, 40 bytes long.
Data: < y''î Ð''î > 10 79 27 27 EE 01 00 00 90 D0 27 27 EE 01 00 00
{73} normal block at 0x000001EE27277E60, 16 bytes long.
Data: < êÏU÷ > 80 EA CF 55 F7 7F 00 00 00 00 00 00 00 00 00 00
{72} normal block at 0x000001EE27277C30, 16 bytes long.
Data: <@éÏU÷ > 40 E9 CF 55 F7 7F 00 00 00 00 00 00 00 00 00 00
{71} normal block at 0x000001EE27278770, 16 bytes long.
Data: <øWÌU÷ > F8 57 CC 55 F7 7F 00 00 00 00 00 00 00 00 00 00
{70} normal block at 0x000001EE272785E0, 16 bytes long.
Data: <ØWÌU÷ > D8 57 CC 55 F7 7F 00 00 00 00 00 00 00 00 00 00
{69} normal block at 0x000001EE27277960, 16 bytes long.
Data: <P ÌU÷ > 50 04 CC 55 F7 7F 00 00 00 00 00 00 00 00 00 00
{68} normal block at 0x000001EE272782C0, 16 bytes long.
Data: <0 ÌU÷ > 30 04 CC 55 F7 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x000001EE27278270, 16 bytes long.
Data: <à ÌU÷ > E0 02 CC 55 F7 7F 00 00 00 00 00 00 00 00 00 00
{66} normal block at 0x000001EE27278220, 16 bytes long.
Data: < ÌU÷ > 10 04 CC 55 F7 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x000001EE27277BE0, 16 bytes long.
Data: <p ÌU÷ > 70 04 CC 55 F7 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x000001EE27277B40, 16 bytes long.
Data: < ÀÊU÷ > 18 C0 CA 55 F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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