Task 38663441
| Name | test_288-GPUGRID_TEST_ATM_40STEP_20261023-4-40-RND8924_0 |
| Workunit | 31606648 |
| Created | 24 Oct 2026, 21:59:51 UTC |
| Sent | 24 Oct 2026, 21:59:59 UTC |
| Report deadline | 29 Oct 2026, 21:59:59 UTC |
| Received | 25 Oct 2026, 13:38:33 UTC |
| Server state | Over |
| Outcome | Success |
| Client state | Done |
| Exit status | 0 (0x00000000) |
| Computer ID | 652341 |
| Run time | 54 min 30 sec |
| CPU time | 37 min 15 sec |
| Validate state | Valid |
| Credit | 60,000.00 |
| Device peak FLOPS | 16,346.66 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 691.73 MB |
| Peak swap size | 2.35 GB |
| Peak disk usage | 3.74 GB |
Stderr output
<core_client_version>8.2.11</core_client_version>
<![CDATA[
<stderr_txt>
00:56:56 (7992): wrapper (7.9.26016): starting
00:56:56 (7992): 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
00:56:58 (7992): Library/usr/bin/tar.exe exited; CPU time 0.078125
00:56:58 (7992): 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\0\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\0\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.
14:03:41 (11452): wrapper (7.9.26016): starting
14:03:41 (11452): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
Ya existe el subdirectorio o el archivo C:\ProgramData\Boinc\slots\0\tmp.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
tar: run.log: file changed as we read it
tar: r*/*.dcd: Cannot stat: No such file or directory
tar: r*/*.xtc: Cannot stat: No such file or directory
tar: Exiting with failure status due to previous errors
14:38:13 (11452): C:/Windows/system32/cmd.exe exited; CPU time 1527.968750
14:38:13 (11452): called boinc_finish(0)
0 bytes in 0 Free Blocks.
460 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: 22766308 bytes.
Dumping objects ->
{1618} normal block at 0x00000233743B4550, 48 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{1607} normal block at 0x00000233743B4400, 48 bytes long.
Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{1596} normal block at 0x00000233743B4390, 48 bytes long.
Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61
{1585} normal block at 0x00000233743B48D0, 48 bytes long.
Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{1574} normal block at 0x00000233743B42B0, 48 bytes long.
Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61
{1543} normal block at 0x000002337439B4B0, 64 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{1532} normal block at 0x000002337439DC20, 102 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) : {1529} normal block at 0x00000233743B5940, 8 bytes long.
Data: < lt3 > 00 00 6C 74 33 02 00 00
{909} normal block at 0x000002337439C030, 102 bytes long.
Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65
{304} normal block at 0x00000233743B4EF0, 8 bytes long.
Data: <P`;t3 > 50 60 3B 74 33 02 00 00
{295} normal block at 0x00000233743A0170, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
{294} normal block at 0x00000233743B5260, 16 bytes long.
Data: <X_;t3 > 58 5F 3B 74 33 02 00 00 00 00 00 00 00 00 00 00
{293} normal block at 0x00000233743B57B0, 16 bytes long.
Data: <0_;t3 > 30 5F 3B 74 33 02 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x00000233743AEF00, 32 bytes long.
Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D
{291} normal block at 0x00000233743B4EA0, 16 bytes long.
Data: < _;t3 > 08 5F 3B 74 33 02 00 00 00 00 00 00 00 00 00 00
{290} normal block at 0x00000233743B56C0, 16 bytes long.
Data: < ^;t3 > E0 5E 3B 74 33 02 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x00000233743B53F0, 16 bytes long.
Data: < ^;t3 > B8 5E 3B 74 33 02 00 00 00 00 00 00 00 00 00 00
{288} normal block at 0x00000233743B5B70, 16 bytes long.
Data: < ^;t3 > 90 5E 3B 74 33 02 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x00000233743B4470, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{286} normal block at 0x00000233743B5760, 16 bytes long.
Data: <H 9t3 > 48 B4 39 74 33 02 00 00 00 00 00 00 00 00 00 00
{285} normal block at 0x00000233743AFA40, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{284} normal block at 0x00000233743B58A0, 16 bytes long.
Data: < 9t3 > 20 B4 39 74 33 02 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x00000233743B5490, 16 bytes long.
Data: < 9t3 > F8 B3 39 74 33 02 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x00000233743B58F0, 16 bytes long.
Data: < 9t3 > D0 B3 39 74 33 02 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x00000233743B4FE0, 16 bytes long.
Data: < 9t3 > A8 B3 39 74 33 02 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x00000233743B5170, 16 bytes long.
Data: < 9t3 > 80 B3 39 74 33 02 00 00 00 00 00 00 00 00 00 00
{278} normal block at 0x00000233743B4DB0, 16 bytes long.
Data: <X 9t3 > 58 B3 39 74 33 02 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x00000233743AF7A0, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{276} normal block at 0x00000233743B5440, 16 bytes long.
Data: <0 9t3 > 30 B3 39 74 33 02 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x000002337439B330, 320 bytes long.
Data: <@T;t3 :t3 > 40 54 3B 74 33 02 00 00 A0 F7 3A 74 33 02 00 00
{274} normal block at 0x00000233743B5120, 16 bytes long.
Data: <p^;t3 > 70 5E 3B 74 33 02 00 00 00 00 00 00 00 00 00 00
{273} normal block at 0x00000233743B5620, 16 bytes long.
Data: <H^;t3 > 48 5E 3B 74 33 02 00 00 00 00 00 00 00 00 00 00
{272} normal block at 0x00000233743AF1A0, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{271} normal block at 0x00000233743B5210, 16 bytes long.
Data: < ^;t3 > 20 5E 3B 74 33 02 00 00 00 00 00 00 00 00 00 00
{270} normal block at 0x00000233743AF9E0, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{269} normal block at 0x00000233743B4E50, 16 bytes long.
Data: <h];t3 > 68 5D 3B 74 33 02 00 00 00 00 00 00 00 00 00 00
{268} normal block at 0x00000233743B4C70, 16 bytes long.
Data: <@];t3 > 40 5D 3B 74 33 02 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x00000233743B59E0, 16 bytes long.
Data: < ];t3 > 18 5D 3B 74 33 02 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x00000233743B51C0, 16 bytes long.
Data: < \;t3 > F0 5C 3B 74 33 02 00 00 00 00 00 00 00 00 00 00
{265} normal block at 0x00000233743B4D10, 16 bytes long.
Data: < \;t3 > C8 5C 3B 74 33 02 00 00 00 00 00 00 00 00 00 00
{264} normal block at 0x00000233743B4D60, 16 bytes long.
Data: < \;t3 > A0 5C 3B 74 33 02 00 00 00 00 00 00 00 00 00 00
{262} normal block at 0x00000233743B4CC0, 16 bytes long.
Data: < C;t3 > 20 43 3B 74 33 02 00 00 00 00 00 00 00 00 00 00
{261} normal block at 0x00000233743B4320, 40 bytes long.
Data: < L;t3 9t3 > C0 4C 3B 74 33 02 00 00 B0 B4 39 74 33 02 00 00
{260} normal block at 0x00000233743B5BC0, 16 bytes long.
Data: < \;t3 > 80 5C 3B 74 33 02 00 00 00 00 00 00 00 00 00 00
{259} normal block at 0x00000233743B5990, 16 bytes long.
Data: <X\;t3 > 58 5C 3B 74 33 02 00 00 00 00 00 00 00 00 00 00
{258} normal block at 0x00000233743AF080, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{257} normal block at 0x00000233743B50D0, 16 bytes long.
Data: <0\;t3 > 30 5C 3B 74 33 02 00 00 00 00 00 00 00 00 00 00
{256} normal block at 0x00000233743B5C30, 992 bytes long.
Data: < P;t3 :t3 > D0 50 3B 74 33 02 00 00 80 F0 3A 74 33 02 00 00
{92} normal block at 0x00000233743AF620, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{91} normal block at 0x00000233743AE710, 16 bytes long.
Data: < 9t3 > B0 DB 39 74 33 02 00 00 00 00 00 00 00 00 00 00
{90} normal block at 0x000002337439DBB0, 40 bytes long.
Data: < :t3 :t3 > 10 E7 3A 74 33 02 00 00 20 F6 3A 74 33 02 00 00
{69} normal block at 0x00000233743AE210, 16 bytes long.
Data: < > 80 EA 91 D1 F7 7F 00 00 00 00 00 00 00 00 00 00
{68} normal block at 0x00000233743AE440, 16 bytes long.
Data: <@ > 40 E9 91 D1 F7 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x00000233743AEAD0, 16 bytes long.
Data: < W > F8 57 8E D1 F7 7F 00 00 00 00 00 00 00 00 00 00
{66} normal block at 0x00000233743AE490, 16 bytes long.
Data: < W > D8 57 8E D1 F7 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x00000233743AE6C0, 16 bytes long.
Data: <P > 50 04 8E D1 F7 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x00000233743AE670, 16 bytes long.
Data: <0 > 30 04 8E D1 F7 7F 00 00 00 00 00 00 00 00 00 00
{63} normal block at 0x00000233743AEC60, 16 bytes long.
Data: < > E0 02 8E D1 F7 7F 00 00 00 00 00 00 00 00 00 00
{62} normal block at 0x00000233743AE3F0, 16 bytes long.
Data: < > 10 04 8E D1 F7 7F 00 00 00 00 00 00 00 00 00 00
{61} normal block at 0x00000233743AE940, 16 bytes long.
Data: <p > 70 04 8E D1 F7 7F 00 00 00 00 00 00 00 00 00 00
{60} normal block at 0x00000233743AE030, 16 bytes long.
Data: < > 18 C0 8C D1 F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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