Task 38583364
| Name | HIF2A_A17_A24_r0_4-QUICO_ATM_GAFF2_LOMAP_HIF2A-4-5-RND6887_0 |
| Workunit | 31547507 |
| Created | 14 Dec 2025, 2:38:34 UTC |
| Sent | 14 Dec 2025, 2:38:48 UTC |
| Report deadline | 19 Dec 2025, 2:38:48 UTC |
| Received | 15 Dec 2025, 5:28:36 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 195 (0x000000C3) EXIT_CHILD_FAILED |
| Computer ID | 642289 |
| Run time | 3 hours 43 min 14 sec |
| CPU time | 3 hours 26 min 53 sec |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 10,947.06 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 472.23 MB |
| Peak swap size | 6.52 GB |
| Peak disk usage | 2.90 GB |
Stderr output
<core_client_version>8.0.2</core_client_version>
<![CDATA[
<message>
The operating system cannot run .
(0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
21:42:14 (30652): wrapper (7.9.26016): starting
21:42:14 (30652): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A17_A24_0.pdb
QB_A17_A24_0.xml
QB_A17_A24_equil.pdb
QB_A17_A24.inpcrd
QB_A17_A24_input.yaml
QB_A17_A24_mdlambda.pdb
QB_A17_A24_min.pdb
QB_A17_A24_npt.pdb
QB_A17_A24.pdb
QB_A17_A24.prmtop
QB_A17_A24_sys.xml
QB_A17_A24_therm.pdb
run.bat
run.sh
21:42:18 (30652): Library/usr/bin/tar.exe exited; CPU time 0.015625
21:42:18 (30652): 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\11\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\11\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.
01:29:32 (30652): C:/Windows/system32/cmd.exe exited; CPU time 12733.187500
01:29:32 (30652): app exit status: 0x40010004
01:29:32 (30652): 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: 285271305 bytes.
Dumping objects ->
{3835523} normal block at 0x000001EE7D355010, 48 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835512} normal block at 0x000001EE7D355160, 48 bytes long.
Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835501} normal block at 0x000001EE7D354980, 48 bytes long.
Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61
{3835490} normal block at 0x000001EE7D3546E0, 48 bytes long.
Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835479} normal block at 0x000001EE7D354F30, 48 bytes long.
Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61
{3835448} normal block at 0x000001EE7D27CE00, 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) : {3835435} normal block at 0x000001EE7B5FDA00, 8 bytes long.
Data: < œ{î > 00 00 9C 7B EE 01 00 00
{3833967} normal block at 0x000001EE7B5FD2D0, 8 bytes long.
Data: <ðÚ^{î > F0 DA 5E 7B EE 01 00 00
..\zip\boinc_zip.cpp(122) : {315} normal block at 0x000001EE7B5F11A0, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{300} normal block at 0x000001EE7B5F1F50, 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 0x000001EE7B605760, 16 bytes long.
Data: < f`{î > 88 66 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{298} normal block at 0x000001EE7B605440, 16 bytes long.
Data: <`f`{î > 60 66 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{297} normal block at 0x000001EE7B5FF530, 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 0x000001EE7B605F30, 16 bytes long.
Data: <8f`{î > 38 66 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{295} normal block at 0x000001EE7B605EE0, 16 bytes long.
Data: < f`{î > 10 66 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{294} normal block at 0x000001EE7B6057B0, 16 bytes long.
Data: <èe`{î > E8 65 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{293} normal block at 0x000001EE7B605E40, 16 bytes long.
Data: <Àe`{î > C0 65 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x000001EE7B6039F0, 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 0x000001EE7B605A30, 16 bytes long.
Data: <hý^{î > 68 FD 5E 7B EE 01 00 00 00 00 00 00 00 00 00 00
{290} normal block at 0x000001EE7B5FF350, 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 0x000001EE7B605580, 16 bytes long.
Data: <@ý^{î > 40 FD 5E 7B EE 01 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x000001EE7B605530, 16 bytes long.
Data: < ý^{î > 18 FD 5E 7B EE 01 00 00 00 00 00 00 00 00 00 00
{286} normal block at 0x000001EE7B605E90, 16 bytes long.
Data: <ðü^{î > F0 FC 5E 7B EE 01 00 00 00 00 00 00 00 00 00 00
{285} normal block at 0x000001EE7B6062A0, 16 bytes long.
Data: <Èü^{î > C8 FC 5E 7B EE 01 00 00 00 00 00 00 00 00 00 00
{284} normal block at 0x000001EE7B605850, 16 bytes long.
Data: < ü^{î > A0 FC 5E 7B EE 01 00 00 00 00 00 00 00 00 00 00
{283} normal block at 0x000001EE7B605DF0, 16 bytes long.
Data: <xü^{î > 78 FC 5E 7B EE 01 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x000001EE7B5FF4D0, 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 0x000001EE7B605710, 16 bytes long.
Data: <Pü^{î > 50 FC 5E 7B EE 01 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x000001EE7B5EFC50, 320 bytes long.
Data: < W`{î Ðô_{î > 10 57 60 7B EE 01 00 00 D0 F4 5F 7B EE 01 00 00
{279} normal block at 0x000001EE7B605B70, 16 bytes long.
Data: < e`{î > A0 65 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{278} normal block at 0x000001EE7B6059E0, 16 bytes long.
Data: <xe`{î > 78 65 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x000001EE7B5FFDD0, 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 0x000001EE7B606070, 16 bytes long.
Data: <Pe`{î > 50 65 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x000001EE7B5FFBF0, 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 0x000001EE7B605990, 16 bytes long.
Data: < d`{î > 98 64 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{273} normal block at 0x000001EE7B606110, 16 bytes long.
Data: <pd`{î > 70 64 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{272} normal block at 0x000001EE7B605D50, 16 bytes long.
Data: <Hd`{î > 48 64 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{271} normal block at 0x000001EE7B6053F0, 16 bytes long.
Data: < d`{î > 20 64 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{270} normal block at 0x000001EE7B6061B0, 16 bytes long.
Data: <øc`{î > F8 63 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{269} normal block at 0x000001EE7B605490, 16 bytes long.
Data: <Ðc`{î > D0 63 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x000001EE7B605C60, 16 bytes long.
Data: < 8`{î > A0 38 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x000001EE7B6038A0, 40 bytes long.
Data: <`\`{î Î'}î > 60 5C 60 7B EE 01 00 00 00 CE 27 7D EE 01 00 00
{265} normal block at 0x000001EE7B605CB0, 16 bytes long.
Data: <°c`{î > B0 63 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{264} normal block at 0x000001EE7B605BC0, 16 bytes long.
Data: < c`{î > 88 63 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{263} normal block at 0x000001EE7B5FF5F0, 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 0x000001EE7B6062F0, 16 bytes long.
Data: <`c`{î > 60 63 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{261} normal block at 0x000001EE7B606360, 992 bytes long.
Data: <ðb`{î ðõ_{î > F0 62 60 7B EE 01 00 00 F0 F5 5F 7B EE 01 00 00
{97} normal block at 0x000001EE7B5FFE30, 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 0x000001EE7B5FD190, 16 bytes long.
Data: <@;`{î > 40 3B 60 7B EE 01 00 00 00 00 00 00 00 00 00 00
{95} normal block at 0x000001EE7B603B40, 40 bytes long.
Data: < Ñ_{î 0þ_{î > 90 D1 5F 7B EE 01 00 00 30 FE 5F 7B EE 01 00 00
{74} normal block at 0x000001EE7B5FDC80, 16 bytes long.
Data: < êÿ¨ö > 80 EA FF A8 F6 7F 00 00 00 00 00 00 00 00 00 00
{73} normal block at 0x000001EE7B5FD5A0, 16 bytes long.
Data: <@éÿ¨ö > 40 E9 FF A8 F6 7F 00 00 00 00 00 00 00 00 00 00
{72} normal block at 0x000001EE7B5FDC30, 16 bytes long.
Data: <øWü¨ö > F8 57 FC A8 F6 7F 00 00 00 00 00 00 00 00 00 00
{71} normal block at 0x000001EE7B5FD6E0, 16 bytes long.
Data: <ØWü¨ö > D8 57 FC A8 F6 7F 00 00 00 00 00 00 00 00 00 00
{70} normal block at 0x000001EE7B5FD0A0, 16 bytes long.
Data: <P ü¨ö > 50 04 FC A8 F6 7F 00 00 00 00 00 00 00 00 00 00
{69} normal block at 0x000001EE7B5FDBE0, 16 bytes long.
Data: <0 ü¨ö > 30 04 FC A8 F6 7F 00 00 00 00 00 00 00 00 00 00
{68} normal block at 0x000001EE7B5FDA50, 16 bytes long.
Data: <à ü¨ö > E0 02 FC A8 F6 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x000001EE7B5FD7D0, 16 bytes long.
Data: < ü¨ö > 10 04 FC A8 F6 7F 00 00 00 00 00 00 00 00 00 00
{66} normal block at 0x000001EE7B5FD000, 16 bytes long.
Data: <p ü¨ö > 70 04 FC A8 F6 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x000001EE7B5FD910, 16 bytes long.
Data: < Àú¨ö > 18 C0 FA A8 F6 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
©2025 Universitat Pompeu Fabra