Task 38664218
| Name | test_74-GPUGRID_TEST_ATM_100SAMPLES_20261025-0-1-RND2754_0 |
| Workunit | 31607388 |
| Created | 24 Oct 2026, 23:21:29 UTC |
| Sent | 24 Oct 2026, 23:21:35 UTC |
| Report deadline | 29 Oct 2026, 23:21:35 UTC |
| Received | 26 Oct 2026, 22:15:53 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 197 (0x000000C5) EXIT_TIME_LIMIT_EXCEEDED |
| Computer ID | 654379 |
| Run time | 4 hours 31 min 46 sec |
| CPU time | 4 hours 31 min 46 sec |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 33,165.87 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 725.56 MB |
| Peak swap size | 13.00 GB |
| Peak disk usage | 2.97 GB |
Stderr output
<core_client_version>8.2.11</core_client_version>
<![CDATA[
<message>
exceeded elapsed time limit 15696.27 (10000000000.00G/637094.13G)</message>
<stderr_txt>
18:33:08 (43480): wrapper (7.9.26016): starting
18:33:08 (43480): 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
18:33:09 (43480): Library/usr/bin/tar.exe exited; CPU time 0.015625
18:33:09 (43480): 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\18\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\18\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) : {3835174} normal block at 0x000001B50834DE50, 8 bytes long.
Data: < - > 00 00 2D 08 B5 01 00 00
..\lib\diagnostics_win.cpp(417) : {3833968} normal block at 0x000001B509FDE5B0, 1080 bytes long.
Data: < , p > 0C 2C 00 00 CD CD CD CD 70 01 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {316} normal block at 0x000001B508351C40, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
08:06:49 (22468): wrapper (7.9.26016): starting
08:06:49 (22468): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\18\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1515} normal block at 0x00000298DC649DC0, 8 bytes long.
Data: < > 00 00 C4 DC 98 02 00 00
..\lib\diagnostics_win.cpp(417) : {309} normal block at 0x00000298DC64A610, 1080 bytes long.
Data: < @ > D0 A8 00 00 CD CD CD CD 40 01 00 00 00 00 00 00
Object dump complete.
17:52:43 (35128): wrapper (7.9.26016): starting
17:52:43 (35128): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\18\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1515} normal block at 0x0000023B7ED06220, 8 bytes long.
Data: < , ; > 00 00 2C 7F 3B 02 00 00
..\lib\diagnostics_win.cpp(417) : {309} normal block at 0x0000023B7ED07010, 1080 bytes long.
Data: <X_ D > 58 5F 00 00 CD CD CD CD 44 01 00 00 00 00 00 00
Object dump complete.
09:23:36 (36672): wrapper (7.9.26016): starting
09:23:36 (36672): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\18\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1515} normal block at 0x000002113BF36990, 8 bytes long.
Data: < ; > 00 00 EF 3B 11 02 00 00
..\lib\diagnostics_win.cpp(417) : {309} normal block at 0x000002113BF36FB0, 1080 bytes long.
Data: <$l T > 24 6C 00 00 CD CD CD CD 54 01 00 00 00 00 00 00
Object dump complete.
11:50:57 (25408): wrapper (7.9.26016): starting
11:50:57 (25408): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\18\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1515} normal block at 0x00000265B7147D60, 8 bytes long.
Data: < h e > 00 00 68 B7 65 02 00 00
..\lib\diagnostics_win.cpp(417) : {309} normal block at 0x00000265B7148470, 1080 bytes long.
Data: < D > D0 09 00 00 CD CD CD CD 44 01 00 00 00 00 00 00
Object dump complete.
12:27:39 (46328): wrapper (7.9.26016): starting
12:27:39 (46328): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\18\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1515} normal block at 0x0000023C7A687ED0, 8 bytes long.
Data: < z< > 00 00 B7 7A 3C 02 00 00
..\lib\diagnostics_win.cpp(417) : {309} normal block at 0x0000023C7A688C20, 1080 bytes long.
Data: <TV H > 54 56 00 00 CD CD CD CD 48 01 00 00 00 00 00 00
Object dump complete.
13:05:50 (18120): wrapper (7.9.26016): starting
13:05:50 (18120): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\18\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1515} normal block at 0x00000189A96F7280, 8 bytes long.
Data: < > 00 00 B9 A9 89 01 00 00
..\lib\diagnostics_win.cpp(417) : {309} normal block at 0x00000189A96F8660, 1080 bytes long.
Data: <$6 L > 24 36 00 00 CD CD CD CD 4C 01 00 00 00 00 00 00
Object dump complete.
13:51:12 (3044): wrapper (7.9.26016): starting
13:51:12 (3044): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\18\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1515} normal block at 0x000001F19F987210, 8 bytes long.
Data: < > 00 00 92 9F F1 01 00 00
..\lib\diagnostics_win.cpp(417) : {309} normal block at 0x000001F19F987820, 1080 bytes long.
Data: < S x > D4 53 00 00 CD CD CD CD 78 00 00 00 00 00 00 00
Object dump complete.
14:29:12 (5768): wrapper (7.9.26016): starting
14:29:12 (5768): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file C:\ProgramData\BOINC\slots\18\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1515} normal block at 0x000001D5502C6B40, 8 bytes long.
Data: < nP > 00 00 6E 50 D5 01 00 00
..\lib\diagnostics_win.cpp(417) : {309} normal block at 0x000001D5502C77F0, 1080 bytes long.
Data: <P D > 50 B6 00 00 CD CD CD CD 44 01 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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