Task 38686086

Name test_60-GPUGRID_TEST_ATM_40STEP_20261023-30-40-RND5548_0
Workunit 31627531
Created 28 Oct 2026, 0:36:23 UTC
Sent 28 Oct 2026, 0:36:27 UTC
Report deadline 2 Nov 2026, 0:36:27 UTC
Received 28 Oct 2026, 0:40:58 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 648183
Run time 2 min 29 sec
CPU time 49 sec
Validate state Invalid
Credit 0.00
Device peak FLOPS 22,859.30 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 453.69 MB
Peak swap size 6.29 GB
Peak disk usage 3.02 GB

Stderr output

<core_client_version>8.2.11</core_client_version>
<![CDATA[
<message>
The operating system cannot run (null).
 (0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
17:32:24 (18712): wrapper (7.9.26016): starting
17:32:24 (18712): 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
17:32:25 (18712): Library/usr/bin/tar.exe exited; CPU time 0.000000
17:32:25 (18712): 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 'C:\ProgramData\BOINC\slots\16\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 'C:\ProgramData\BOINC\slots\16\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.
tar: r0/checkpoint.xml: time stamp 2026-10-27 20:35:31 is 10973.4551614 s in the future
tar: r1/checkpoint.xml: time stamp 2026-10-27 20:35:31 is 10973.1293368 s in the future
tar: r10/checkpoint.xml: time stamp 2026-10-27 20:35:34 is 10975.7981952 s in the future
tar: r11/checkpoint.xml: time stamp 2026-10-27 20:35:35 is 10976.4679047 s in the future
tar: r12/checkpoint.xml: time stamp 2026-10-27 20:35:35 is 10976.1348284 s in the future
tar: r13/checkpoint.xml: time stamp 2026-10-27 20:35:35 is 10975.8058337 s in the future
tar: r14/checkpoint.xml: time stamp 2026-10-27 20:35:36 is 10976.4815926 s in the future
tar: r15/checkpoint.xml: time stamp 2026-10-27 20:35:36 is 10976.1571444 s in the future
tar: r16/checkpoint.xml: time stamp 2026-10-27 20:35:36 is 10975.8323212 s in the future
tar: r17/checkpoint.xml: time stamp 2026-10-27 20:35:37 is 10976.5035906 s in the future
tar: r18/checkpoint.xml: time stamp 2026-10-27 20:35:37 is 10976.1795044 s in the future
tar: r19/checkpoint.xml: time stamp 2026-10-27 20:35:37 is 10975.8553782 s in the future
tar: r2/checkpoint.xml: time stamp 2026-10-27 20:35:32 is 10970.5273132 s in the future
tar: r20/checkpoint.xml: time stamp 2026-10-27 20:35:37 is 10975.2001332 s in the future
tar: r21/checkpoint.xml: time stamp 2026-10-27 20:35:38 is 10975.8775313 s in the future
tar: r3/checkpoint.xml: time stamp 2026-10-27 20:35:32 is 10969.5519616 s in the future
tar: r4/checkpoint.xml: time stamp 2026-10-27 20:35:32 is 10969.2223081 s in the future
tar: r5/checkpoint.xml: time stamp 2026-10-27 20:35:33 is 10969.8964358 s in the future
tar: r6/checkpoint.xml: time stamp 2026-10-27 20:35:33 is 10969.5698203 s in the future
tar: r7/checkpoint.xml: time stamp 2026-10-27 20:35:33 is 10969.2443 s in the future
tar: r8/checkpoint.xml: time stamp 2026-10-27 20:35:34 is 10969.9351862 s in the future
tar: r9/checkpoint.xml: time stamp 2026-10-27 20:35:34 is 10969.6118893 s in the future
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 "C:\ProgramData\BOINC\slots\16\Scripts\rbfe_production.exe\__main__.py", line 7, in <module>
  File "C:\ProgramData\BOINC\slots\16\Lib\site-packages\atom_openmm\rbfe_production.py", line 29, in rbfe_production
    rx = openmm_job_RBFE(
         ^^^^^^^^^^^^^^^^
  File "C:\ProgramData\BOINC\slots\16\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 "C:\ProgramData\BOINC\slots\16\Lib\site-packages\atom_openmm\ommworker.py", line 53, in __init__
    self.start_worker()
  File "C:\ProgramData\BOINC\slots\16\Lib\site-packages\atom_openmm\ommworker.py", line 444, in start_worker
    self._openmm_worker_makecontext()
  File "C:\ProgramData\BOINC\slots\16\Lib\site-packages\atom_openmm\ommworker.py", line 251, in _openmm_worker_makecontext
    self.simulation = Simulation(self.topology, self.system, self.integrator, self.platform, self.platform_properties)
                      ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
  File "C:\ProgramData\BOINC\slots\16\Lib\site-packages\openmm\app\simulation.py", line 106, in __init__
    self.context = mm.Context(self.system, self.integrator, platform, platformProperties)
                   ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
  File "C:\ProgramData\BOINC\slots\16\Lib\site-packages\openmm\openmm.py", line 5082, in __init__
    _openmm.Context_swiginit(self, _openmm.new_Context(*args))
                                   ^^^^^^^^^^^^^^^^^^^^^^^^^^
openmm.OpenMMException: Error loading CUDA module: CUDA_ERROR_JIT_COMPILER_NOT_FOUND (221)
17:33:39 (18712): C:/Windows/system32/cmd.exe exited; CPU time 49.062500
17:33:39 (18712): app exit status: 0x16
17:33:39 (18712): 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: 1199781 bytes.
Dumping objects ->
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{3835177} normal block at 0x000001933E059410, 48 bytes long.
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{3835166} normal block at 0x000001933E059720, 48 bytes long.
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{3835155} normal block at 0x000001933E059250, 48 bytes long.
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{3835124} normal block at 0x000001933FD865C0, 64 bytes long.
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..\api\boinc_api.cpp(309) : {3835111} normal block at 0x000001933E02DF60, 8 bytes long.
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{294} normal block at 0x000001933E0361F0, 16 bytes long.
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{290} normal block at 0x000001933E030780, 48 bytes long.
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{284} normal block at 0x000001933E0363D0, 16 bytes long.
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{283} normal block at 0x000001933E036970, 16 bytes long.
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{282} normal block at 0x000001933E0366F0, 16 bytes long.
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{281} normal block at 0x000001933E036380, 16 bytes long.
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{280} normal block at 0x000001933E0300D0, 32 bytes long.
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{279} normal block at 0x000001933E035F20, 16 bytes long.
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{276} normal block at 0x000001933E036880, 16 bytes long.
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{71} normal block at 0x000001933E02DD30, 16 bytes long.
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{69} normal block at 0x000001933E02DBA0, 16 bytes long.
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{66} normal block at 0x000001933E02DE70, 16 bytes long.
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{65} normal block at 0x000001933E02DA60, 16 bytes long.
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{64} normal block at 0x000001933E02DDD0, 16 bytes long.
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{63} normal block at 0x000001933E02D790, 16 bytes long.
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Object dump complete.

</stderr_txt>
]]>


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