Task 38617422

Name HIF2A_2_A39_A05_r0_5-QUICO_ATM_GAFF2_NAGL_hif2a_2-3-6-RND8470_0
Workunit 31569089
Created 18 Apr 2026, 4:15:25 UTC
Sent 18 Apr 2026, 4:15:33 UTC
Report deadline 23 Apr 2026, 4:15:33 UTC
Received 18 Apr 2026, 4:28:22 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 33 sec
CPU time 14 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 161.64 MB
Peak swap size 10.30 GB
Peak disk usage 2.79 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>
13:26:29 (33404): wrapper (7.9.26016): starting
13:26:29 (33404): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A39_A05_0.pdb
QB_A39_A05_0.xml
QB_A39_A05.inpcrd
QB_A39_A05_input.yaml
QB_A39_A05.pdb
QB_A39_A05.prmtop
QB_A39_A05_sys.xml
run.bat
run.sh
13:26:30 (33404): Library/usr/bin/tar.exe exited; CPU time 0.015625
13:26:30 (33404): 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\BOINC&#131;f&#129;[&#131;^\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\BOINC&#131;f&#129;[&#131;^\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\BOINC&#131;f&#129;[&#131;^\slots\1\Scripts\rbfe_production.exe\__main__.py", line 7, in <module>
  File "F:\BOINC\BOINC&#131;f&#129;[&#131;^\slots\1\Lib\site-packages\atom_openmm\rbfe_production.py", line 29, in rbfe_production
    rx = openmm_job_RBFE(
         ^^^^^^^^^^^^^^^^
  File "F:\BOINC\BOINC&#131;f&#129;[&#131;^\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\BOINC&#131;f&#129;[&#131;^\slots\1\Lib\site-packages\atom_openmm\ommworker.py", line 53, in __init__
    self.start_worker()
  File "F:\BOINC\BOINC&#131;f&#129;[&#131;^\slots\1\Lib\site-packages\atom_openmm\ommworker.py", line 444, in start_worker
    self._openmm_worker_makecontext()
  File "F:\BOINC\BOINC&#131;f&#129;[&#131;^\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\BOINC&#131;f&#129;[&#131;^\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"
13:27:05 (33404): C:/Windows/system32/cmd.exe exited; CPU time 14.015625
13:27:05 (33404): app exit status: 0x16
13:27:05 (33404): 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: 865735 bytes.
Dumping objects ->
{3835376} normal block at 0x000002181C220D80, 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 0x000002181C221560, 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 0x000002181C2213A0, 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 0x000002181C2214F0, 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 0x000002181C221330, 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 0x000002181C6CA360, 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 0x000002181A55DA10, 8 bytes long.
 Data: <  M     > 00 00 4D 1A 18 02 00 00 
{3834045} normal block at 0x000002181A55DE70, 8 bytes long.
 Data: < xb     > F0 78 62 1C 18 02 00 00 
..\zip\boinc_zip.cpp(122) : {309} normal block at 0x000002181A5572C0, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{294} normal block at 0x000002181A5561C0, 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 0x000002181A569860, 16 bytes long.
 Data: <&#200;&#163;V             > C8 A3 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{292} normal block at 0x000002181A569630, 16 bytes long.
 Data: < &#163;V             > A0 A3 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{291} normal block at 0x000002181A565670, 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 0x000002181A5695E0, 16 bytes long.
 Data: <x&#163;V             > 78 A3 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{289} normal block at 0x000002181A569680, 16 bytes long.
 Data: <P&#163;V             > 50 A3 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{288} normal block at 0x000002181A569AE0, 16 bytes long.
 Data: <(&#163;V             > 28 A3 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{287} normal block at 0x000002181A5699F0, 16 bytes long.
 Data: < &#163;V             > 00 A3 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{286} normal block at 0x000002181A563AD0, 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 0x000002181A569A90, 16 bytes long.
 Data: < LU             > 18 4C 55 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{284} normal block at 0x000002181A565310, 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 0x000002181A5697C0, 16 bytes long.
 Data: < KU             > F0 4B 55 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{281} normal block at 0x000002181A5691D0, 16 bytes long.
 Data: <&#200;KU             > C8 4B 55 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{280} normal block at 0x000002181A569590, 16 bytes long.
 Data: < KU             > A0 4B 55 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{279} normal block at 0x000002181A569130, 16 bytes long.
 Data: <xKU             > 78 4B 55 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{278} normal block at 0x000002181A569EF0, 16 bytes long.
 Data: <PKU             > 50 4B 55 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{277} normal block at 0x000002181A5690E0, 16 bytes long.
 Data: <(KU             > 28 4B 55 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{276} normal block at 0x000002181A565730, 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 0x000002181A569270, 16 bytes long.
 Data: < KU             > 00 4B 55 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{274} normal block at 0x000002181A554B00, 320 bytes long.
 Data: <p V     0WV     > 70 92 56 1A 18 02 00 00 30 57 56 1A 18 02 00 00 
{273} normal block at 0x000002181A569A40, 16 bytes long.
 Data: < &#162;V             > E0 A2 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{272} normal block at 0x000002181A56A030, 16 bytes long.
 Data: <&#184;&#162;V             > B8 A2 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{271} normal block at 0x000002181A5651F0, 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 0x000002181A569310, 16 bytes long.
 Data: < &#162;V             > 90 A2 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{269} normal block at 0x000002181A565BB0, 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 0x000002181A569540, 16 bytes long.
 Data: <&#216;&#161;V             > D8 A1 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{267} normal block at 0x000002181A569D10, 16 bytes long.
 Data: <&#176;&#161;V             > B0 A1 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{266} normal block at 0x000002181A569EA0, 16 bytes long.
 Data: < &#161;V             > 88 A1 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{265} normal block at 0x000002181A569770, 16 bytes long.
 Data: <`&#161;V             > 60 A1 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{264} normal block at 0x000002181A569720, 16 bytes long.
 Data: <8&#161;V             > 38 A1 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{263} normal block at 0x000002181A5694A0, 16 bytes long.
 Data: < &#161;V             > 10 A1 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{261} normal block at 0x000002181A569400, 16 bytes long.
 Data: < 9V             > 80 39 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{260} normal block at 0x000002181A563980, 40 bytes long.
 Data: <  V     `&#163;l     > 00 94 56 1A 18 02 00 00 60 A3 6C 1C 18 02 00 00 
{259} normal block at 0x000002181A569F90, 16 bytes long.
 Data: <  V             > F0 A0 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{258} normal block at 0x000002181A569E50, 16 bytes long.
 Data: <&#200; V             > C8 A0 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{257} normal block at 0x000002181A565490, 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 0x000002181A5694F0, 16 bytes long.
 Data: <  V             > A0 A0 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{255} normal block at 0x000002181A56A0A0, 992 bytes long.
 Data: <  V      TV     > F0 94 56 1A 18 02 00 00 90 54 56 1A 18 02 00 00 
{91} normal block at 0x000002181A565190, 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 0x000002181A55DA60, 16 bytes long.
 Data: < <V             > 90 3C 56 1A 18 02 00 00 00 00 00 00 00 00 00 00 
{89} normal block at 0x000002181A563C90, 40 bytes long.
 Data: <`&#218;U      QV     > 60 DA 55 1A 18 02 00 00 90 51 56 1A 18 02 00 00 
{66} normal block at 0x000002181A55DB50, 16 bytes long.
 Data: <                > 80 EA F5 0E F6 7F 00 00 00 00 00 00 00 00 00 00 
{65} normal block at 0x000002181A55D560, 16 bytes long.
 Data: <@               > 40 E9 F5 0E F6 7F 00 00 00 00 00 00 00 00 00 00 
{64} normal block at 0x000002181A55D240, 16 bytes long.
 Data: < W              > F8 57 F2 0E F6 7F 00 00 00 00 00 00 00 00 00 00 
{63} normal block at 0x000002181A55DF10, 16 bytes long.
 Data: <&#216;W              > D8 57 F2 0E F6 7F 00 00 00 00 00 00 00 00 00 00 
{62} normal block at 0x000002181A55DE20, 16 bytes long.
 Data: <P               > 50 04 F2 0E F6 7F 00 00 00 00 00 00 00 00 00 00 
{61} normal block at 0x000002181A55D470, 16 bytes long.
 Data: <0               > 30 04 F2 0E F6 7F 00 00 00 00 00 00 00 00 00 00 
{60} normal block at 0x000002181A55D420, 16 bytes long.
 Data: <                > E0 02 F2 0E F6 7F 00 00 00 00 00 00 00 00 00 00 
{59} normal block at 0x000002181A55D100, 16 bytes long.
 Data: <                > 10 04 F2 0E F6 7F 00 00 00 00 00 00 00 00 00 00 
{58} normal block at 0x000002181A55DF60, 16 bytes long.
 Data: <p               > 70 04 F2 0E F6 7F 00 00 00 00 00 00 00 00 00 00 
{57} normal block at 0x000002181A55D600, 16 bytes long.
 Data: < &#192;              > 18 C0 F0 0E F6 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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