Task 38645938

Name	test_61-GPUGRID_TEST_ATM_1000_20261023-0-1-RND6513_0
Workunit	31590898
Created	23 Oct 2026, 16:19:31 UTC
Sent	23 Oct 2026, 16:39:14 UTC
Report deadline	28 Oct 2026, 16:39:14 UTC
Received	28 Oct 2026, 9:49:51 UTC
Server state	Over
Outcome	Computation error
Client state	Compute error
Exit status	197 (0x000000C5) EXIT_TIME_LIMIT_EXCEEDED
Computer ID	609331
Run time	4 days 17 hours 9 min 4 sec
CPU time	4 days 15 hours 6 min 24 sec
Validate state	Invalid
Credit	0.00
Device peak FLOPS	13,213.22 GFLOPS
Application version	ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64
Peak working set size	661.76 MB
Peak swap size	6.90 GB
Peak disk usage	2.97 GB

Stderr output

<core_client_version>8.2.11</core_client_version> <![CDATA[ <message> exceeded elapsed time limit 407343.02 (10000000000.00G/24549.33G)</message> <stderr_txt> 19:41:17 (26620): wrapper (7.9.26016): starting 19:41:17 (26620): 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 19:41:19 (26620): Library/usr/bin/tar.exe exited; CPU time 0.000000 19:41:19 (26620): 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\16\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\16\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. Detected memory leaks! Dumping objects -> ..\api\boinc_api.cpp(309) : {3835465} normal block at 0x000001A9C42EF550, 8 bytes long. Data: < k > 00 00 6B C4 A9 01 00 00 ..\lib\diagnostics_win.cpp(417) : {3833952} normal block at 0x000001A9C5F577F0, 1080 bytes long. Data: < ` > CC 60 00 00 CD CD CD CD FC 01 00 00 00 00 00 00 ..\zip\boinc_zip.cpp(122) : {308} normal block at 0x000001A9C42ED050, 260 bytes long. Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 Object dump complete. </stderr_txt> ]]>