Task 38678709

Name test_658-GPUGRID_TEST_ATM_40STEP_20261023-24-40-RND9199_0
Workunit 31620517
Created 26 Oct 2026, 18:14:57 UTC
Sent 26 Oct 2026, 18:15:04 UTC
Report deadline 31 Oct 2026, 18:15:04 UTC
Received 26 Oct 2026, 18:17:37 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 650591
Run time 59 sec
CPU time
Validate state Invalid
Credit 0.00
Device peak FLOPS 32,075.31 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 49.05 MB
Peak swap size 37.44 MB
Peak disk usage 1.49 GB

Stderr output

<core_client_version>8.2.11</core_client_version>
<![CDATA[
<message>
(null) nelze spustit.
 (0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
19:16:21 (20012): wrapper (7.9.26016): starting
19:16:21 (20012): 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
19:16:22 (20012): Library/usr/bin/tar.exe exited; CPU time 0.000000
19:16:22 (20012): 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 'G:\BOINC\DATA\slots\8\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 'G:\BOINC\DATA\slots\8\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 "G:\BOINC\DATA\slots\8\Scripts\rbfe_production.exe\__main__.py", line 7, in <module>
  File "G:\BOINC\DATA\slots\8\Lib\site-packages\atom_openmm\rbfe_production.py", line 10, in rbfe_production
    from atom_openmm.openmm_async_re import openmm_job_RBFE
  File "G:\BOINC\DATA\slots\8\Lib\site-packages\atom_openmm\openmm_async_re.py", line 10, in <module>
    import openmm as mm
  File "G:\BOINC\DATA\slots\8\Lib\site-packages\openmm\__init__.py", line 24, in <module>
    from openmm.openmm import *
  File "G:\BOINC\DATA\slots\8\Lib\site-packages\openmm\openmm.py", line 10, in <module>
    from . import _openmm
ImportError: DLL load failed while importing _openmm: Uveden&#253; modul nebyl nalezen.
19:16:33 (20012): C:/Windows/system32/cmd.exe exited; CPU time 0.546875
19:16:33 (20012): app exit status: 0x16
19:16:33 (20012): called boinc_finish(195)
0 bytes in 0 Free Blocks.
176 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: 348997 bytes.
Dumping objects ->
{3835187} normal block at 0x000001A31C4D7EB0, 48 bytes long.
 Data: <PATH=G:\BOINC\DA> 50 41 54 48 3D 47 3A 5C 42 4F 49 4E 43 5C 44 41 
{3835176} normal block at 0x000001A31E252C30, 32 bytes long.
 Data: <HOME=G:\BOINC\DA> 48 4F 4D 45 3D 47 3A 5C 42 4F 49 4E 43 5C 44 41 
{3835165} normal block at 0x000001A31E252ED0, 32 bytes long.
 Data: <TMP=G:\BOINC\DAT> 54 4D 50 3D 47 3A 5C 42 4F 49 4E 43 5C 44 41 54 
{3835154} normal block at 0x000001A31E253350, 32 bytes long.
 Data: <TEMP=G:\BOINC\DA> 54 45 4D 50 3D 47 3A 5C 42 4F 49 4E 43 5C 44 41 
{3835143} normal block at 0x000001A31E253770, 32 bytes long.
 Data: <TMPDIR=G:\BOINC\> 54 4D 50 44 49 52 3D 47 3A 5C 42 4F 49 4E 43 5C 
{3835112} normal block at 0x000001A31C4D7E40, 48 bytes long.
 Data: <PATH=G:\BOINC\DA> 50 41 54 48 3D 47 3A 5C 42 4F 49 4E 43 5C 44 41 
..\api\boinc_api.cpp(309) : {3835099} normal block at 0x000001A31C4CF7A0, 8 bytes long.
 Data: <  I &#163;   > 00 00 49 1C A3 01 00 00 
{3833951} normal block at 0x000001A31C4CEBC0, 8 bytes long.
 Data: <&#176;&#201;% &#163;   > B0 C9 25 1E A3 01 00 00 
..\zip\boinc_zip.cpp(122) : {307} normal block at 0x000001A31C4D3100, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{292} normal block at 0x000001A31C4BCCB0, 80 bytes long.
 Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C 
{291} normal block at 0x000001A31C4D6900, 16 bytes long.
 Data: <(xM &#163;           > 28 78 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{290} normal block at 0x000001A31C4D6AE0, 16 bytes long.
 Data: < xM &#163;           > 00 78 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{289} normal block at 0x000001A31C4D0C70, 32 bytes long.
 Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D 
{288} normal block at 0x000001A31C4D6720, 16 bytes long.
 Data: <&#216;wM &#163;           > D8 77 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{287} normal block at 0x000001A31C4D6BD0, 16 bytes long.
 Data: <&#176;wM &#163;           > B0 77 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{286} normal block at 0x000001A31C4D6770, 16 bytes long.
 Data: < wM &#163;           > 88 77 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x000001A31C4D6590, 16 bytes long.
 Data: <`wM &#163;           > 60 77 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{284} normal block at 0x000001A31C4D7F20, 48 bytes long.
 Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F 
{283} normal block at 0x000001A31C4D7300, 16 bytes long.
 Data: <X M &#163;           > 58 05 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x000001A31C4D1210, 32 bytes long.
 Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69 
{281} normal block at 0x000001A31C4D6A90, 16 bytes long.
 Data: <0 M &#163;           > 30 05 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{279} normal block at 0x000001A31C4D6EA0, 16 bytes long.
 Data: <  M &#163;           > 08 05 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{278} normal block at 0x000001A31C4D6B80, 16 bytes long.
 Data: <&#224; M &#163;           > E0 04 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{277} normal block at 0x000001A31C4D6860, 16 bytes long.
 Data: <&#184; M &#163;           > B8 04 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{276} normal block at 0x000001A31C4D70D0, 16 bytes long.
 Data: <  M &#163;           > 90 04 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{275} normal block at 0x000001A31C4D6810, 16 bytes long.
 Data: <h M &#163;           > 68 04 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{274} normal block at 0x000001A31C4D1510, 32 bytes long.
 Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55 
{273} normal block at 0x000001A31C4D6D60, 16 bytes long.
 Data: <@ M &#163;           > 40 04 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{272} normal block at 0x000001A31C4D0440, 320 bytes long.
 Data: <`mM &#163;     M &#163;   > 60 6D 4D 1C A3 01 00 00 10 15 4D 1C A3 01 00 00 
{271} normal block at 0x000001A31C4D6C20, 16 bytes long.
 Data: <@wM &#163;           > 40 77 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x000001A31C4D69A0, 16 bytes long.
 Data: < wM &#163;           > 18 77 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{269} normal block at 0x000001A31C4D1150, 32 bytes long.
 Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65 
{268} normal block at 0x000001A31C4D7080, 16 bytes long.
 Data: <&#240;vM &#163;           > F0 76 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{267} normal block at 0x000001A31C4D0970, 32 bytes long.
 Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62 
{266} normal block at 0x000001A31C4D6D10, 16 bytes long.
 Data: <8vM &#163;           > 38 76 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{265} normal block at 0x000001A31C4D6DB0, 16 bytes long.
 Data: < vM &#163;           > 10 76 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{264} normal block at 0x000001A31C4D66D0, 16 bytes long.
 Data: <&#232;uM &#163;           > E8 75 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{263} normal block at 0x000001A31C4D7210, 16 bytes long.
 Data: <&#192;uM &#163;           > C0 75 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{262} normal block at 0x000001A31C4D7490, 16 bytes long.
 Data: < uM &#163;           > 98 75 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{261} normal block at 0x000001A31C4D73A0, 16 bytes long.
 Data: <puM &#163;           > 70 75 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{259} normal block at 0x000001A31C4D6540, 16 bytes long.
 Data: < &#229;K &#163;           > 80 E5 4B 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{258} normal block at 0x000001A31C4BE580, 40 bytes long.
 Data: <@eM &#163;   @~M &#163;   > 40 65 4D 1C A3 01 00 00 40 7E 4D 1C A3 01 00 00 
{257} normal block at 0x000001A31C4D72B0, 16 bytes long.
 Data: <PuM &#163;           > 50 75 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{256} normal block at 0x000001A31C4D7440, 16 bytes long.
 Data: <(uM &#163;           > 28 75 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{255} normal block at 0x000001A31C4D11B0, 32 bytes long.
 Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F 
{254} normal block at 0x000001A31C4D6A40, 16 bytes long.
 Data: < uM &#163;           > 00 75 4D 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{253} normal block at 0x000001A31C4D7500, 992 bytes long.
 Data: <@jM &#163;   &#176; M &#163;   > 40 6A 4D 1C A3 01 00 00 B0 11 4D 1C A3 01 00 00 
{89} normal block at 0x000001A31C4D1270, 32 bytes long.
 Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F 
{88} normal block at 0x000001A31C4CF700, 16 bytes long.
 Data: < &#218;K &#163;           > 20 DA 4B 1C A3 01 00 00 00 00 00 00 00 00 00 00 
{87} normal block at 0x000001A31C4BDA20, 40 bytes long.
 Data: < &#247;L &#163;   p M &#163;   > 00 F7 4C 1C A3 01 00 00 70 12 4D 1C A3 01 00 00 
{66} normal block at 0x000001A31C4CF3E0, 16 bytes long.
 Data: < &#234; E&#246;           > 80 EA 7F 45 F6 7F 00 00 00 00 00 00 00 00 00 00 
{65} normal block at 0x000001A31C4CEB70, 16 bytes long.
 Data: <@&#233; E&#246;           > 40 E9 7F 45 F6 7F 00 00 00 00 00 00 00 00 00 00 
{64} normal block at 0x000001A31C4CEB20, 16 bytes long.
 Data: <&#248;W|E&#246;           > F8 57 7C 45 F6 7F 00 00 00 00 00 00 00 00 00 00 
{63} normal block at 0x000001A31C4CEDF0, 16 bytes long.
 Data: <&#216;W|E&#246;           > D8 57 7C 45 F6 7F 00 00 00 00 00 00 00 00 00 00 
{62} normal block at 0x000001A31C4CF6B0, 16 bytes long.
 Data: <P |E&#246;           > 50 04 7C 45 F6 7F 00 00 00 00 00 00 00 00 00 00 
{61} normal block at 0x000001A31C4CF2F0, 16 bytes long.
 Data: <0 |E&#246;           > 30 04 7C 45 F6 7F 00 00 00 00 00 00 00 00 00 00 
{60} normal block at 0x000001A31C4CEC10, 16 bytes long.
 Data: <&#224; |E&#246;           > E0 02 7C 45 F6 7F 00 00 00 00 00 00 00 00 00 00 
{59} normal block at 0x000001A31C4CED00, 16 bytes long.
 Data: <  |E&#246;           > 10 04 7C 45 F6 7F 00 00 00 00 00 00 00 00 00 00 
{58} normal block at 0x000001A31C4CEC60, 16 bytes long.
 Data: <p |E&#246;           > 70 04 7C 45 F6 7F 00 00 00 00 00 00 00 00 00 00 
{57} normal block at 0x000001A31C4CF840, 16 bytes long.
 Data: < &#192;zE&#246;           > 18 C0 7A 45 F6 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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