Task 38618087

Name HIF2A_2_A17_A16_r0_5-QUICO_ATM_GAFF2_NAGL_hif2a_2-2-6-RND8809_0
Workunit 31569638
Created 18 Apr 2026, 9:46:08 UTC
Sent 18 Apr 2026, 9:46:13 UTC
Report deadline 23 Apr 2026, 9:46:13 UTC
Received 18 Apr 2026, 9:52:25 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 37 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 220.02 MB
Peak swap size 10.36 GB
Peak disk usage 1.44 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>
18:50:23 (7836): wrapper (7.9.26016): starting
18:50:23 (7836): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A17_A16_0.pdb
QB_A17_A16_0.xml
QB_A17_A16.inpcrd
QB_A17_A16_input.yaml
QB_A17_A16.pdb
QB_A17_A16.prmtop
QB_A17_A16_sys.xml
run.bat
run.sh
18:50:26 (7836): Library/usr/bin/tar.exe exited; CPU time 0.000000
18:50:26 (7836): 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"
18:51:02 (7836): C:/Windows/system32/cmd.exe exited; CPU time 14.593750
18:51:02 (7836): app exit status: 0x16
18:51:02 (7836): 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: 694745 bytes.
Dumping objects ->
{3835380} normal block at 0x0000029710C01020, 48 bytes long.
 Data: <PATH=F:\BOINC\BO> 50 41 54 48 3D 46 3A 5C 42 4F 49 4E 43 5C 42 4F 
{3835369} normal block at 0x0000029710C00A70, 48 bytes long.
 Data: <HOME=F:\BOINC\BO> 48 4F 4D 45 3D 46 3A 5C 42 4F 49 4E 43 5C 42 4F 
{3835358} normal block at 0x0000029710C01560, 48 bytes long.
 Data: <TMP=F:\BOINC\BOI> 54 4D 50 3D 46 3A 5C 42 4F 49 4E 43 5C 42 4F 49 
{3835347} normal block at 0x0000029710C00990, 48 bytes long.
 Data: <TEMP=F:\BOINC\BO> 54 45 4D 50 3D 46 3A 5C 42 4F 49 4E 43 5C 42 4F 
{3835336} normal block at 0x0000029710C00FB0, 48 bytes long.
 Data: <TMPDIR=F:\BOINC\> 54 4D 50 44 49 52 3D 46 3A 5C 42 4F 49 4E 43 5C 
{3835305} normal block at 0x00000297110E7BD0, 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) : {3835292} normal block at 0x000002970EF9C4F0, 8 bytes long.
 Data: <  T     > 00 00 54 0F 97 02 00 00 
{3834049} normal block at 0x000002970EF9BD70, 8 bytes long.
 Data: <        > A0 94 FA 0E 97 02 00 00 
..\zip\boinc_zip.cpp(122) : {310} normal block at 0x000002970EF97DA0, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{295} normal block at 0x000002970EF969D0, 80 bytes long.
 Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C 
{294} normal block at 0x000002970EFAA0B0, 16 bytes long.
 Data: <h&#172;              > 68 AC FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{293} normal block at 0x000002970EFA9A20, 16 bytes long.
 Data: <@&#172;              > 40 AC FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{292} normal block at 0x000002970EFA3BC0, 32 bytes long.
 Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D 
{291} normal block at 0x000002970EFA9B60, 16 bytes long.
 Data: < &#172;              > 18 AC FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{290} normal block at 0x000002970EFA99D0, 16 bytes long.
 Data: < &#171;              > F0 AB FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{289} normal block at 0x000002970EFA9CA0, 16 bytes long.
 Data: <&#200;&#171;              > C8 AB FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{288} normal block at 0x000002970EFAA8D0, 16 bytes long.
 Data: < &#171;              > A0 AB FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{287} normal block at 0x000002970EFA5B70, 48 bytes long.
 Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F 
{286} normal block at 0x000002970EFAA790, 16 bytes long.
 Data: < 3              > F8 33 F9 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x000002970EFA43A0, 32 bytes long.
 Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69 
{284} normal block at 0x000002970EFAA1A0, 16 bytes long.
 Data: <&#208;3              > D0 33 F9 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x000002970EFAA6A0, 16 bytes long.
 Data: <&#168;3              > A8 33 F9 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{281} normal block at 0x000002970EFA9ED0, 16 bytes long.
 Data: < 3              > 80 33 F9 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{280} normal block at 0x000002970EFAA4C0, 16 bytes long.
 Data: <X3              > 58 33 F9 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{279} normal block at 0x000002970EFAA060, 16 bytes long.
 Data: <03              > 30 33 F9 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{278} normal block at 0x000002970EFAA6F0, 16 bytes long.
 Data: < 3              > 08 33 F9 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{277} normal block at 0x000002970EFA4280, 32 bytes long.
 Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55 
{276} normal block at 0x000002970EFA9A70, 16 bytes long.
 Data: < 2              > E0 32 F9 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{275} normal block at 0x000002970EF932E0, 320 bytes long.
 Data: <p        B      > 70 9A FA 0E 97 02 00 00 80 42 FA 0E 97 02 00 00 
{274} normal block at 0x000002970EFAA740, 16 bytes long.
 Data: < &#171;              > 80 AB FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{273} normal block at 0x000002970EFA9C00, 16 bytes long.
 Data: <X&#171;              > 58 AB FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{272} normal block at 0x000002970EFA4100, 32 bytes long.
 Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65 
{271} normal block at 0x000002970EFA9980, 16 bytes long.
 Data: <0&#171;              > 30 AB FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x000002970EFA4460, 32 bytes long.
 Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62 
{269} normal block at 0x000002970EFA9E80, 16 bytes long.
 Data: <x&#170;              > 78 AA FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x000002970EFA9B10, 16 bytes long.
 Data: <P&#170;              > 50 AA FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{267} normal block at 0x000002970EFA9FC0, 16 bytes long.
 Data: <(&#170;              > 28 AA FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{266} normal block at 0x000002970EFAA150, 16 bytes long.
 Data: < &#170;              > 00 AA FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{265} normal block at 0x000002970EFA9F70, 16 bytes long.
 Data: <&#216;&#169;              > D8 A9 FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{264} normal block at 0x000002970EFAA560, 16 bytes long.
 Data: <&#176;&#169;              > B0 A9 FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{262} normal block at 0x000002970EFAA100, 16 bytes long.
 Data: <@Y              > 40 59 FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{261} normal block at 0x000002970EFA5940, 40 bytes long.
 Data: < &#161;      &#208;{      > 00 A1 FA 0E 97 02 00 00 D0 7B 0E 11 97 02 00 00 
{260} normal block at 0x000002970EFAA470, 16 bytes long.
 Data: < &#169;              > 90 A9 FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{259} normal block at 0x000002970EFAA600, 16 bytes long.
 Data: <h&#169;              > 68 A9 FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{258} normal block at 0x000002970EFA4580, 32 bytes long.
 Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F 
{257} normal block at 0x000002970EFA9F20, 16 bytes long.
 Data: <@&#169;              > 40 A9 FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{256} normal block at 0x000002970EFAA940, 992 bytes long.
 Data: <         E      > 20 9F FA 0E 97 02 00 00 80 45 FA 0E 97 02 00 00 
{92} normal block at 0x000002970EFA46A0, 32 bytes long.
 Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F 
{91} normal block at 0x000002970EF9C950, 16 bytes long.
 Data: < Z              > 20 5A FA 0E 97 02 00 00 00 00 00 00 00 00 00 00 
{90} normal block at 0x000002970EFA5A20, 40 bytes long.
 Data: <P&#201;       F      > 50 C9 F9 0E 97 02 00 00 A0 46 FA 0E 97 02 00 00 
{67} normal block at 0x000002970EF9C400, 16 bytes long.
 Data: <   F            > 80 EA 85 46 F6 7F 00 00 00 00 00 00 00 00 00 00 
{66} normal block at 0x000002970EF9C900, 16 bytes long.
 Data: <@  F            > 40 E9 85 46 F6 7F 00 00 00 00 00 00 00 00 00 00 
{65} normal block at 0x000002970EF9C860, 16 bytes long.
 Data: < W F            > F8 57 82 46 F6 7F 00 00 00 00 00 00 00 00 00 00 
{64} normal block at 0x000002970EF9C3B0, 16 bytes long.
 Data: <&#216;W F            > D8 57 82 46 F6 7F 00 00 00 00 00 00 00 00 00 00 
{63} normal block at 0x000002970EF9C2C0, 16 bytes long.
 Data: <P  F            > 50 04 82 46 F6 7F 00 00 00 00 00 00 00 00 00 00 
{62} normal block at 0x000002970EF9C270, 16 bytes long.
 Data: <0  F            > 30 04 82 46 F6 7F 00 00 00 00 00 00 00 00 00 00 
{61} normal block at 0x000002970EF9C7C0, 16 bytes long.
 Data: <   F            > E0 02 82 46 F6 7F 00 00 00 00 00 00 00 00 00 00 
{60} normal block at 0x000002970EF9C220, 16 bytes long.
 Data: <   F            > 10 04 82 46 F6 7F 00 00 00 00 00 00 00 00 00 00 
{59} normal block at 0x000002970EF9C720, 16 bytes long.
 Data: <p  F            > 70 04 82 46 F6 7F 00 00 00 00 00 00 00 00 00 00 
{58} normal block at 0x000002970EF9C090, 16 bytes long.
 Data: < &#192; F            > 18 C0 80 46 F6 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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