Task 38579931

Name JNK1_A38_A37_r2_1-QUICO_ATM_GAFF2_LOMAP_JNK1-0-5-RND8358_2
Workunit 31545123
Created 11 Dec 2025, 13:29:42 UTC
Sent 11 Dec 2025, 13:29:50 UTC
Report deadline 16 Dec 2025, 13:29:50 UTC
Received 11 Dec 2025, 13:42:47 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 628418
Run time 1 min 51 sec
CPU time 1 sec
Validate state Invalid
Credit 0.00
Device peak FLOPS 9,334.02 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 46.80 MB
Peak swap size 34.97 MB
Peak disk usage 2.81 GB

Stderr output

<core_client_version>8.0.2</core_client_version>
<![CDATA[
<message>
(unknown error) (0) - exit code 195 (0xc3)</message>
<stderr_txt>
13:36:02 (41180): wrapper (7.9.26016): starting
13:36:02 (41180): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A38_A37_0.pdb
QB_A38_A37_0.xml
QB_A38_A37_equil.pdb
QB_A38_A37.inpcrd
QB_A38_A37_input.yaml
QB_A38_A37_mdlambda.pdb
QB_A38_A37_min.pdb
QB_A38_A37_npt.pdb
QB_A38_A37_out_merged_nowater.pdb
QB_A38_A37.pdb
QB_A38_A37.prmtop
QB_A38_A37_sys.xml
QB_A38_A37_therm.pdb
run.bat
run.sh
13:36:04 (41180): Library/usr/bin/tar.exe exited; CPU time 0.015625
13:36:04 (41180): 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 'D:\BOINC_DATA\slots\15\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.
  Running command git version
  git version 2.47.0.windows.1
  Running command git clone --filter=blob:none https://github.com/Acellera/atm.git 'D:\BOINC_DATA\slots\15\pip-req-build-nfi2raef'
  Cloning into 'D:\BOINC_DATA\slots\15\pip-req-build-nfi2raef'...
  fatal: unable to access 'https://github.com/Acellera/atm.git/': Recv failure: Connection was reset
  error: subprocess-exited-with-error
  
  git clone --filter=blob:none https://github.com/Acellera/atm.git 'D:\BOINC_DATA\slots\15\pip-req-build-nfi2raef' did not run successfully.
  exit code: 128
  
  See above for output.
  
  note: This error originates from a subprocess, and is likely not a problem with pip.
  full command: git clone --filter=blob:none https://github.com/Acellera/atm.git 'D:\BOINC_DATA\slots\15\pip-req-build-nfi2raef'
  cwd: [inherit]
error: subprocess-exited-with-error

git clone --filter=blob:none https://github.com/Acellera/atm.git 'D:\BOINC_DATA\slots\15\pip-req-build-nfi2raef' did not run successfully.
exit code: 128

See above for output.

note: This error originates from a subprocess, and is likely not a problem with pip.
python.exe: can't open file 'D:\\BOINC_DATA\\slots\\15\\Scripts\\rbfe_production.exe': [Errno 2] No such file or directory
13:36:38 (41180): C:/Windows/system32/cmd.exe exited; CPU time 1.796875
13:36:38 (41180): app exit status: 0x16
13:36:38 (41180): called boinc_finish(195)
0 bytes in 0 Free Blocks.
536 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: 972141 bytes.
Dumping objects ->
{3835327} normal block at 0x0000028913FB16B0, 48 bytes long.
 Data: <PATH=D:\BOINC_DA> 50 41 54 48 3D 44 3A 5C 42 4F 49 4E 43 5F 44 41 
{3835316} normal block at 0x00000289140F6290, 32 bytes long.
 Data: <HOME=D:\BOINC_DA> 48 4F 4D 45 3D 44 3A 5C 42 4F 49 4E 43 5F 44 41 
{3835305} normal block at 0x00000289140F5F90, 32 bytes long.
 Data: <TMP=D:\BOINC_DAT> 54 4D 50 3D 44 3A 5C 42 4F 49 4E 43 5F 44 41 54 
{3835294} normal block at 0x00000289140F5E70, 32 bytes long.
 Data: <TEMP=D:\BOINC_DA> 54 45 4D 50 3D 44 3A 5C 42 4F 49 4E 43 5F 44 41 
{3835283} normal block at 0x00000289140F61D0, 32 bytes long.
 Data: <TMPDIR=D:\BOINC_> 54 4D 50 44 49 52 3D 44 3A 5C 42 4F 49 4E 43 5F 
{3835252} normal block at 0x0000028913FB1020, 48 bytes long.
 Data: <PATH=D:\BOINC_DA> 50 41 54 48 3D 44 3A 5C 42 4F 49 4E 43 5F 44 41 
{3835241} normal block at 0x0000028914132E90, 180 bytes long.
 Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65 
..\api\boinc_api.cpp(309) : {3835238} normal block at 0x0000028912376AA0, 8 bytes long.
 Data: <  . &#137;   > 00 00 2E 12 89 02 00 00 
{3834596} normal block at 0x0000028914132800, 180 bytes long.
 Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65 
{3833967} normal block at 0x0000028912376A50, 8 bytes long.
 Data: <&#192;+  &#137;   > C0 2B 10 14 89 02 00 00 
..\zip\boinc_zip.cpp(122) : {315} normal block at 0x0000028912381B90, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{300} normal block at 0x0000028912366230, 80 bytes long.
 Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C 
{299} normal block at 0x0000028912383850, 16 bytes long.
 Data: <x?8 &#137;           > 78 3F 38 12 89 02 00 00 00 00 00 00 00 00 00 00 
{298} normal block at 0x0000028912383800, 16 bytes long.
 Data: <P?8 &#137;           > 50 3F 38 12 89 02 00 00 00 00 00 00 00 00 00 00 
{297} normal block at 0x000002891237BF00, 32 bytes long.
 Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D 
{296} normal block at 0x0000028912383710, 16 bytes long.
 Data: <(?8 &#137;           > 28 3F 38 12 89 02 00 00 00 00 00 00 00 00 00 00 
{295} normal block at 0x0000028912382E00, 16 bytes long.
 Data: < ?8 &#137;           > 00 3F 38 12 89 02 00 00 00 00 00 00 00 00 00 00 
{294} normal block at 0x0000028912382D10, 16 bytes long.
 Data: <&#216;>8 &#137;           > D8 3E 38 12 89 02 00 00 00 00 00 00 00 00 00 00 
{293} normal block at 0x0000028912382CC0, 16 bytes long.
 Data: <&#176;>8 &#137;           > B0 3E 38 12 89 02 00 00 00 00 00 00 00 00 00 00 
{292} normal block at 0x000002891237D6C0, 48 bytes long.
 Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F 
{291} normal block at 0x0000028912383620, 16 bytes long.
 Data: <&#200;a6 &#137;           > C8 61 36 12 89 02 00 00 00 00 00 00 00 00 00 00 
{290} normal block at 0x000002891237BAE0, 32 bytes long.
 Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69 
{289} normal block at 0x0000028912383760, 16 bytes long.
 Data: <&#160;a6 &#137;           > A0 61 36 12 89 02 00 00 00 00 00 00 00 00 00 00 
{287} normal block at 0x00000289123835D0, 16 bytes long.
 Data: <xa6 &#137;           > 78 61 36 12 89 02 00 00 00 00 00 00 00 00 00 00 
{286} normal block at 0x0000028912383580, 16 bytes long.
 Data: <Pa6 &#137;           > 50 61 36 12 89 02 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x0000028912383530, 16 bytes long.
 Data: <(a6 &#137;           > 28 61 36 12 89 02 00 00 00 00 00 00 00 00 00 00 
{284} normal block at 0x0000028912382C20, 16 bytes long.
 Data: < a6 &#137;           > 00 61 36 12 89 02 00 00 00 00 00 00 00 00 00 00 
{283} normal block at 0x00000289123834E0, 16 bytes long.
 Data: <&#216;`6 &#137;           > D8 60 36 12 89 02 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x000002891237BF60, 32 bytes long.
 Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55 
{281} normal block at 0x00000289123833F0, 16 bytes long.
 Data: <&#176;`6 &#137;           > B0 60 36 12 89 02 00 00 00 00 00 00 00 00 00 00 
{280} normal block at 0x00000289123660B0, 320 bytes long.
 Data: <&#240;38 &#137;   `&#191;7 &#137;   > F0 33 38 12 89 02 00 00 60 BF 37 12 89 02 00 00 
{279} normal block at 0x0000028912382BD0, 16 bytes long.
 Data: < >8 &#137;           > 90 3E 38 12 89 02 00 00 00 00 00 00 00 00 00 00 
{278} normal block at 0x0000028912382F40, 16 bytes long.
 Data: <h>8 &#137;           > 68 3E 38 12 89 02 00 00 00 00 00 00 00 00 00 00 
{277} normal block at 0x000002891237C320, 32 bytes long.
 Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65 
{276} normal block at 0x0000028912382B80, 16 bytes long.
 Data: <@>8 &#137;           > 40 3E 38 12 89 02 00 00 00 00 00 00 00 00 00 00 
{275} normal block at 0x000002891237C500, 32 bytes long.
 Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62 
{274} normal block at 0x00000289123836C0, 16 bytes long.
 Data: < =8 &#137;           > 88 3D 38 12 89 02 00 00 00 00 00 00 00 00 00 00 
{273} normal block at 0x00000289123833A0, 16 bytes long.
 Data: <`=8 &#137;           > 60 3D 38 12 89 02 00 00 00 00 00 00 00 00 00 00 
{272} normal block at 0x0000028912383260, 16 bytes long.
 Data: <8=8 &#137;           > 38 3D 38 12 89 02 00 00 00 00 00 00 00 00 00 00 
{271} normal block at 0x0000028912383210, 16 bytes long.
 Data: < =8 &#137;           > 10 3D 38 12 89 02 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x0000028912383300, 16 bytes long.
 Data: <&#232;<8 &#137;           > E8 3C 38 12 89 02 00 00 00 00 00 00 00 00 00 00 
{269} normal block at 0x0000028912383440, 16 bytes long.
 Data: <&#192;<8 &#137;           > C0 3C 38 12 89 02 00 00 00 00 00 00 00 00 00 00 
{267} normal block at 0x00000289123831C0, 16 bytes long.
 Data: < &#219;7 &#137;           > 20 DB 37 12 89 02 00 00 00 00 00 00 00 00 00 00 
{266} normal block at 0x000002891237DB20, 40 bytes long.
 Data: <&#192;18 &#137;     &#251; &#137;   > C0 31 38 12 89 02 00 00 20 10 FB 13 89 02 00 00 
{265} normal block at 0x0000028912383170, 16 bytes long.
 Data: <&#160;<8 &#137;           > A0 3C 38 12 89 02 00 00 00 00 00 00 00 00 00 00 
{264} normal block at 0x00000289123837B0, 16 bytes long.
 Data: <x<8 &#137;           > 78 3C 38 12 89 02 00 00 00 00 00 00 00 00 00 00 
{263} normal block at 0x000002891237C620, 32 bytes long.
 Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F 
{262} normal block at 0x0000028912383120, 16 bytes long.
 Data: <P<8 &#137;           > 50 3C 38 12 89 02 00 00 00 00 00 00 00 00 00 00 
{261} normal block at 0x0000028912383C50, 992 bytes long.
 Data: < 18 &#137;    &#198;7 &#137;   > 20 31 38 12 89 02 00 00 20 C6 37 12 89 02 00 00 
{97} normal block at 0x000002891237B900, 32 bytes long.
 Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F 
{96} normal block at 0x0000028912376DC0, 16 bytes long.
 Data: <p&#213;7 &#137;           > 70 D5 37 12 89 02 00 00 00 00 00 00 00 00 00 00 
{95} normal block at 0x000002891237D570, 40 bytes long.
 Data: <&#192;m7 &#137;    &#185;7 &#137;   > C0 6D 37 12 89 02 00 00 00 B9 37 12 89 02 00 00 
{74} normal block at 0x0000028912377900, 16 bytes long.
 Data: < &#234;'|&#247;           > 80 EA 27 7C F7 7F 00 00 00 00 00 00 00 00 00 00 
{73} normal block at 0x0000028912377220, 16 bytes long.
 Data: <@&#233;'|&#247;           > 40 E9 27 7C F7 7F 00 00 00 00 00 00 00 00 00 00 
{72} normal block at 0x0000028912377860, 16 bytes long.
 Data: <&#248;W$|&#247;           > F8 57 24 7C F7 7F 00 00 00 00 00 00 00 00 00 00 
{71} normal block at 0x00000289123779A0, 16 bytes long.
 Data: <&#216;W$|&#247;           > D8 57 24 7C F7 7F 00 00 00 00 00 00 00 00 00 00 
{70} normal block at 0x0000028912377040, 16 bytes long.
 Data: <P $|&#247;           > 50 04 24 7C F7 7F 00 00 00 00 00 00 00 00 00 00 
{69} normal block at 0x0000028912376C80, 16 bytes long.
 Data: <0 $|&#247;           > 30 04 24 7C F7 7F 00 00 00 00 00 00 00 00 00 00 
{68} normal block at 0x00000289123771D0, 16 bytes long.
 Data: <&#224; $|&#247;           > E0 02 24 7C F7 7F 00 00 00 00 00 00 00 00 00 00 
{67} normal block at 0x0000028912377130, 16 bytes long.
 Data: <  $|&#247;           > 10 04 24 7C F7 7F 00 00 00 00 00 00 00 00 00 00 
{66} normal block at 0x0000028912377770, 16 bytes long.
 Data: <p $|&#247;           > 70 04 24 7C F7 7F 00 00 00 00 00 00 00 00 00 00 
{65} normal block at 0x00000289123770E0, 16 bytes long.
 Data: < &#192;"|&#247;           > 18 C0 22 7C F7 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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