Task 38627784

Name PTP1B_A12_A05_r0_4-QUICO_ATM_OpenFF23_NAGL_PTP1B-2-6-RND6057_1
Workunit 31577512
Created 24 Apr 2026, 13:18:35 UTC
Sent 24 Apr 2026, 13:19:28 UTC
Report deadline 29 Apr 2026, 13:19:28 UTC
Received 24 Apr 2026, 13:30:25 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 651931
Run time 2 min 7 sec
CPU time 4 sec
Validate state Invalid
Credit 0.00
Device peak FLOPS 15,305.92 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 44.48 MB
Peak swap size 31.37 MB
Peak disk usage 1.56 GB

Stderr output

<core_client_version>8.2.9</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>
22:28:05 (17304): wrapper (7.9.26016): starting
22:28:05 (17304): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A12_A05_0.pdb
QB_A12_A05_0.xml
QB_A12_A05.inpcrd
QB_A12_A05_input.yaml
QB_A12_A05.pdb
QB_A12_A05.prmtop
QB_A12_A05_sys.xml
run.bat
run.sh
22:28:08 (17304): Library/usr/bin/tar.exe exited; CPU time 0.015625
22:28:08 (17304): 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\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 'C:\ProgramData\BOINC\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.
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\0\Scripts\rbfe_production.exe\__main__.py", line 7, in <module>
  File "C:\ProgramData\BOINC\slots\0\Lib\site-packages\atom_openmm\rbfe_production.py", line 10, in rbfe_production
    from atom_openmm.openmm_async_re import openmm_job_RBFE
  File "C:\ProgramData\BOINC\slots\0\Lib\site-packages\atom_openmm\openmm_async_re.py", line 10, in <module>
    import openmm as mm
  File "C:\ProgramData\BOINC\slots\0\Lib\site-packages\openmm\__init__.py", line 24, in <module>
    from openmm.openmm import *
  File "C:\ProgramData\BOINC\slots\0\Lib\site-packages\openmm\openmm.py", line 10, in <module>
    from . import _openmm
ImportError: DLL load failed while importing _openmm: &#142;w&#146;&#232;&#130;&#179;&#130;&#234;&#130;&#189;&#131;&#130;&#131;W&#131;&#133;&#129;[&#131;&#139;&#130;&#170;&#140;&#169;&#130;&#194;&#130;&#169;&#130;&#232;&#130;&#220;&#130;&#185;&#130;&#241;&#129;B
22:28:36 (17304): C:/Windows/system32/cmd.exe exited; CPU time 4.906250
22:28:36 (17304): app exit status: 0x16
22:28:36 (17304): 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: 827791 bytes.
Dumping objects ->
{3835680} normal block at 0x000001682705D260, 48 bytes long.
 Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835669} normal block at 0x000001682705D7A0, 48 bytes long.
 Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835658} normal block at 0x00000168250A5D60, 48 bytes long.
 Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61 
{3835647} normal block at 0x00000168250A5BA0, 48 bytes long.
 Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835636} normal block at 0x00000168250A5AC0, 48 bytes long.
 Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61 
{3835605} normal block at 0x00000168270A4CC0, 64 bytes long.
 Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
..\api\boinc_api.cpp(309) : {3835592} normal block at 0x000001682509DAA0, 8 bytes long.
 Data: <   %h   > 00 00 07 25 68 01 00 00 
{3834065} normal block at 0x000001682509DF50, 8 bytes long.
 Data: < D 'h   > F0 44 10 27 68 01 00 00 
..\zip\boinc_zip.cpp(122) : {314} normal block at 0x00000168250915B0, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{299} normal block at 0x00000168250927A0, 80 bytes long.
 Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C 
{298} normal block at 0x00000168250A6560, 16 bytes long.
 Data: <Xt %h           > 58 74 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{297} normal block at 0x00000168250A6DD0, 16 bytes long.
 Data: <0t %h           > 30 74 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{296} normal block at 0x00000168250A1410, 32 bytes long.
 Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D 
{295} normal block at 0x00000168250A6470, 16 bytes long.
 Data: < t %h           > 08 74 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{294} normal block at 0x00000168250A6970, 16 bytes long.
 Data: < s %h           > E0 73 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{293} normal block at 0x00000168250A6F10, 16 bytes long.
 Data: <&#184;s %h           > B8 73 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{292} normal block at 0x00000168250A60B0, 16 bytes long.
 Data: < s %h           > 90 73 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{291} normal block at 0x00000168250A5EB0, 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 0x00000168250A6D80, 16 bytes long.
 Data: <H  %h           > 48 12 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{289} normal block at 0x00000168250A1830, 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 0x00000168250A6100, 16 bytes long.
 Data: <   %h           > 20 12 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{286} normal block at 0x00000168250A66F0, 16 bytes long.
 Data: <   %h           > F8 11 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x00000168250A6880, 16 bytes long.
 Data: <&#208;  %h           > D0 11 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{284} normal block at 0x00000168250A6AB0, 16 bytes long.
 Data: <&#168;  %h           > A8 11 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{283} normal block at 0x00000168250A61F0, 16 bytes long.
 Data: <   %h           > 80 11 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x00000168250A6010, 16 bytes long.
 Data: <X  %h           > 58 11 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{281} normal block at 0x00000168250A1E30, 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 0x00000168250A6D30, 16 bytes long.
 Data: <0  %h           > 30 11 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{279} normal block at 0x00000168250A1130, 320 bytes long.
 Data: <0m %h   0  %h   > 30 6D 0A 25 68 01 00 00 30 1E 0A 25 68 01 00 00 
{278} normal block at 0x00000168250A6420, 16 bytes long.
 Data: <ps %h           > 70 73 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{277} normal block at 0x00000168250A6830, 16 bytes long.
 Data: <Hs %h           > 48 73 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{276} normal block at 0x00000168250A22B0, 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 0x00000168250A6920, 16 bytes long.
 Data: < s %h           > 20 73 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{274} normal block at 0x00000168250A1650, 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 0x00000168250A6EC0, 16 bytes long.
 Data: <hr %h           > 68 72 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{272} normal block at 0x00000168250A66A0, 16 bytes long.
 Data: <@r %h           > 40 72 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{271} normal block at 0x00000168250A68D0, 16 bytes long.
 Data: < r %h           > 18 72 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x00000168250A6290, 16 bytes long.
 Data: < q %h           > F0 71 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{269} normal block at 0x00000168250A6E70, 16 bytes long.
 Data: <&#200;q %h           > C8 71 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x00000168250A6C40, 16 bytes long.
 Data: < q %h           > A0 71 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{266} normal block at 0x00000168250A6BF0, 16 bytes long.
 Data: <pY %h           > 70 59 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{265} normal block at 0x00000168250A5970, 40 bytes long.
 Data: < k %h   &#192;L 'h   > F0 6B 0A 25 68 01 00 00 C0 4C 0A 27 68 01 00 00 
{264} normal block at 0x00000168250A6A60, 16 bytes long.
 Data: < q %h           > 80 71 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{263} normal block at 0x00000168250A61A0, 16 bytes long.
 Data: <Xq %h           > 58 71 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{262} normal block at 0x00000168250A1470, 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 0x00000168250A6240, 16 bytes long.
 Data: <0q %h           > 30 71 0A 25 68 01 00 00 00 00 00 00 00 00 00 00 
{260} normal block at 0x00000168250A7130, 992 bytes long.
 Data: <@b %h   p  %h   > 40 62 0A 25 68 01 00 00 70 14 0A 25 68 01 00 00 
{96} normal block at 0x00000168250A1770, 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 0x000001682509DD20, 16 bytes long.
 Data: < &#193; %h           > E0 C1 08 25 68 01 00 00 00 00 00 00 00 00 00 00 
{94} normal block at 0x000001682508C1E0, 40 bytes long.
 Data: < &#221;	%h   p  %h   > 20 DD 09 25 68 01 00 00 70 17 0A 25 68 01 00 00 
{71} normal block at 0x000001682509E7C0, 16 bytes long.
 Data: <   &#191;            > 80 EA 01 BF F7 7F 00 00 00 00 00 00 00 00 00 00 
{70} normal block at 0x000001682509DF00, 16 bytes long.
 Data: <@  &#191;            > 40 E9 01 BF F7 7F 00 00 00 00 00 00 00 00 00 00 
{69} normal block at 0x000001682509DB90, 16 bytes long.
 Data: < W &#190;            > F8 57 FE BE F7 7F 00 00 00 00 00 00 00 00 00 00 
{68} normal block at 0x000001682509E8B0, 16 bytes long.
 Data: <&#216;W &#190;            > D8 57 FE BE F7 7F 00 00 00 00 00 00 00 00 00 00 
{67} normal block at 0x000001682509E680, 16 bytes long.
 Data: <P  &#190;            > 50 04 FE BE F7 7F 00 00 00 00 00 00 00 00 00 00 
{66} normal block at 0x000001682509E630, 16 bytes long.
 Data: <0  &#190;            > 30 04 FE BE F7 7F 00 00 00 00 00 00 00 00 00 00 
{65} normal block at 0x000001682509DEB0, 16 bytes long.
 Data: <   &#190;            > E0 02 FE BE F7 7F 00 00 00 00 00 00 00 00 00 00 
{64} normal block at 0x000001682509E770, 16 bytes long.
 Data: <   &#190;            > 10 04 FE BE F7 7F 00 00 00 00 00 00 00 00 00 00 
{63} normal block at 0x000001682509E950, 16 bytes long.
 Data: <p  &#190;            > 70 04 FE BE F7 7F 00 00 00 00 00 00 00 00 00 00 
{62} normal block at 0x000001682509E360, 16 bytes long.
 Data: < &#192; &#190;            > 18 C0 FC BE F7 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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