Task 38664269

Name test_89-GPUGRID_TEST_ATM_100SAMPLES_20261025-0-1-RND1569_0
Workunit 31607437
Created 24 Oct 2026, 23:24:35 UTC
Sent 24 Oct 2026, 23:24:52 UTC
Report deadline 29 Oct 2026, 23:24:52 UTC
Received 25 Oct 2026, 5:52:34 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 598225
Run time 4 hours 55 min 51 sec
CPU time 4 hours 53 min 26 sec
Validate state Invalid
Credit 0.00
Device peak FLOPS 10,947.62 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 836.66 MB
Peak swap size 6.90 GB
Peak disk usage 3.85 GB

Stderr output

<core_client_version>8.0.2</core_client_version>
<![CDATA[
<message>
The operating system cannot run (null).
 (0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
20:47:41 (195928): wrapper (7.9.26016): starting
20:47:41 (195928): 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
20:47:43 (195928): Library/usr/bin/tar.exe exited; CPU time 0.031250
20:47:43 (195928): 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\11\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\11\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 "C:\ProgramData\BOINC\slots\11\Scripts\rbfe_production.exe\__main__.py", line 7, in <module>
  File "C:\ProgramData\BOINC\slots\11\Lib\site-packages\atom_openmm\rbfe_production.py", line 33, in rbfe_production
    rx.scheduleJobs()
  File "C:\ProgramData\BOINC\slots\11\Lib\site-packages\atom_openmm\async_re.py", line 321, in scheduleJobs
    self.transport.ProcessJobQueue(min_time,cycle_time)
  File "C:\ProgramData\BOINC\slots\11\Lib\site-packages\atom_openmm\local_openmm_transport.py", line 186, in ProcessJobQueue
    self.isDone(repl,0)
  File "C:\ProgramData\BOINC\slots\11\Lib\site-packages\atom_openmm\local_openmm_transport.py", line 287, in isDone
    retcode = self._update_replica(job)
              ^^^^^^^^^^^^^^^^^^^^^^^^^
  File "C:\ProgramData\BOINC\slots\11\Lib\site-packages\atom_openmm\local_openmm_transport.py", line 210, in _update_replica
    (pos,vel) = job['openmm_worker'].get_posvel()
                ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
  File "C:\ProgramData\BOINC\slots\11\Lib\site-packages\atom_openmm\ommworker.py", line 467, in get_posvel
    state = self.context.getState(getPositions=True, getVelocities=True)
            ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
  File "C:\ProgramData\BOINC\slots\11\Lib\site-packages\openmm\openmm.py", line 5022, in getState
    state = _openmm.Context_getState(self, types, enforcePeriodicBox, groups_mask)
            ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
openmm.OpenMMException: Error downloading array posq: CUDA_ERROR_ILLEGAL_ADDRESS (700)
01:50:35 (195928): C:/Windows/system32/cmd.exe exited; CPU time 17606.875000
01:50:35 (195928): app exit status: 0x16
01:50:35 (195928): called boinc_finish(195)
0 bytes in 0 Free Blocks.
658 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: 319176063 bytes.
Dumping objects ->
{3835319} normal block at 0x000002342EEFCB60, 48 bytes long.
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{3835308} normal block at 0x000002342D165310, 48 bytes long.
 Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835297} normal block at 0x000002342D1652A0, 48 bytes long.
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{3835286} normal block at 0x000002342D165230, 48 bytes long.
 Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835275} normal block at 0x000002342D165150, 48 bytes long.
 Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61 
{3835244} normal block at 0x000002342EF47590, 64 bytes long.
 Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835233} normal block at 0x000002342D15B9C0, 201 bytes long.
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..\api\boinc_api.cpp(309) : {3835230} normal block at 0x000002342D15D940, 8 bytes long.
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{3834586} normal block at 0x000002342D15B250, 201 bytes long.
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{3833961} normal block at 0x000002342D15D490, 8 bytes long.
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..\zip\boinc_zip.cpp(122) : {312} normal block at 0x000002342D161950, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{297} normal block at 0x000002342D1562F0, 80 bytes long.
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{296} normal block at 0x000002342D165D90, 16 bytes long.
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{295} normal block at 0x000002342D166010, 16 bytes long.
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{294} normal block at 0x000002342D15FA80, 32 bytes long.
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{293} normal block at 0x000002342D165D40, 16 bytes long.
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{292} normal block at 0x000002342D166100, 16 bytes long.
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{291} normal block at 0x000002342D165A20, 16 bytes long.
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{290} normal block at 0x000002342D165C50, 16 bytes long.
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{289} normal block at 0x000002342D1651C0, 48 bytes long.
 Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F 
{288} normal block at 0x000002342D166060, 16 bytes long.
 Data: <(&#147; -4           > 28 93 15 2D 34 02 00 00 00 00 00 00 00 00 00 00 
{287} normal block at 0x000002342D15F5A0, 32 bytes long.
 Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69 
{286} normal block at 0x000002342D1661F0, 16 bytes long.
 Data: < &#147; -4           > 00 93 15 2D 34 02 00 00 00 00 00 00 00 00 00 00 
{284} normal block at 0x000002342D166830, 16 bytes long.
 Data: <&#216;&#146; -4           > D8 92 15 2D 34 02 00 00 00 00 00 00 00 00 00 00 
{283} normal block at 0x000002342D166150, 16 bytes long.
 Data: <&#176;&#146; -4           > B0 92 15 2D 34 02 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x000002342D1661A0, 16 bytes long.
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{281} normal block at 0x000002342D1667E0, 16 bytes long.
 Data: <`&#146; -4           > 60 92 15 2D 34 02 00 00 00 00 00 00 00 00 00 00 
{280} normal block at 0x000002342D165F20, 16 bytes long.
 Data: <8&#146; -4           > 38 92 15 2D 34 02 00 00 00 00 00 00 00 00 00 00 
{279} normal block at 0x000002342D15F480, 32 bytes long.
 Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55 
{278} normal block at 0x000002342D166740, 16 bytes long.
 Data: < &#146; -4           > 10 92 15 2D 34 02 00 00 00 00 00 00 00 00 00 00 
{277} normal block at 0x000002342D159210, 320 bytes long.
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{276} normal block at 0x000002342D165B60, 16 bytes long.
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{275} normal block at 0x000002342D165ED0, 16 bytes long.
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{274} normal block at 0x000002342D15F900, 32 bytes long.
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{273} normal block at 0x000002342D165CA0, 16 bytes long.
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{272} normal block at 0x000002342D160020, 32 bytes long.
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{271} normal block at 0x000002342D1665B0, 16 bytes long.
 Data: <&#200;j -4           > C8 6A 16 2D 34 02 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x000002342D165C00, 16 bytes long.
 Data: <&#160;j -4           > A0 6A 16 2D 34 02 00 00 00 00 00 00 00 00 00 00 
{269} normal block at 0x000002342D166560, 16 bytes long.
 Data: <xj -4           > 78 6A 16 2D 34 02 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x000002342D1666F0, 16 bytes long.
 Data: <Pj -4           > 50 6A 16 2D 34 02 00 00 00 00 00 00 00 00 00 00 
{267} normal block at 0x000002342D1664C0, 16 bytes long.
 Data: <(j -4           > 28 6A 16 2D 34 02 00 00 00 00 00 00 00 00 00 00 
{266} normal block at 0x000002342D165B10, 16 bytes long.
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{264} normal block at 0x000002342D165A70, 16 bytes long.
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{263} normal block at 0x000002342D164C10, 40 bytes long.
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{262} normal block at 0x000002342D165AC0, 16 bytes long.
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{261} normal block at 0x000002342D166650, 16 bytes long.
 Data: <&#184;i -4           > B8 69 16 2D 34 02 00 00 00 00 00 00 00 00 00 00 
{260} normal block at 0x000002342D15F4E0, 32 bytes long.
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{259} normal block at 0x000002342D166600, 16 bytes long.
 Data: < i -4           > 90 69 16 2D 34 02 00 00 00 00 00 00 00 00 00 00 
{258} normal block at 0x000002342D166990, 992 bytes long.
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{94} normal block at 0x000002342D15F3C0, 32 bytes long.
 Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F 
{93} normal block at 0x000002342D15E3E0, 16 bytes long.
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{92} normal block at 0x000002342D14C900, 40 bytes long.
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{71} normal block at 0x000002342D15DB20, 16 bytes long.
 Data: < &#234;&#246;&#246;&#246;           > 80 EA F6 F6 F6 7F 00 00 00 00 00 00 00 00 00 00 
{70} normal block at 0x000002342D15DCB0, 16 bytes long.
 Data: <@&#233;&#246;&#246;&#246;           > 40 E9 F6 F6 F6 7F 00 00 00 00 00 00 00 00 00 00 
{69} normal block at 0x000002342D15E200, 16 bytes long.
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{68} normal block at 0x000002342D15DFD0, 16 bytes long.
 Data: <&#216;W&#243;&#246;&#246;           > D8 57 F3 F6 F6 7F 00 00 00 00 00 00 00 00 00 00 
{67} normal block at 0x000002342D15DC10, 16 bytes long.
 Data: <P &#243;&#246;&#246;           > 50 04 F3 F6 F6 7F 00 00 00 00 00 00 00 00 00 00 
{66} normal block at 0x000002342D15E390, 16 bytes long.
 Data: <0 &#243;&#246;&#246;           > 30 04 F3 F6 F6 7F 00 00 00 00 00 00 00 00 00 00 
{65} normal block at 0x000002342D15E2F0, 16 bytes long.
 Data: <&#224; &#243;&#246;&#246;           > E0 02 F3 F6 F6 7F 00 00 00 00 00 00 00 00 00 00 
{64} normal block at 0x000002342D15E070, 16 bytes long.
 Data: <  &#243;&#246;&#246;           > 10 04 F3 F6 F6 7F 00 00 00 00 00 00 00 00 00 00 
{63} normal block at 0x000002342D15D6C0, 16 bytes long.
 Data: <p &#243;&#246;&#246;           > 70 04 F3 F6 F6 7F 00 00 00 00 00 00 00 00 00 00 
{62} normal block at 0x000002342D15DA80, 16 bytes long.
 Data: < &#192;&#241;&#246;&#246;           > 18 C0 F1 F6 F6 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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