Task 38683029
| Name | test_443-GPUGRID_TEST_ATM_40STEP_20261023-24-40-RND4852_0 |
| Workunit | 31624614 |
| Created | 27 Oct 2026, 10:09:06 UTC |
| Sent | 27 Oct 2026, 10:09:10 UTC |
| Report deadline | 1 Nov 2026, 10:09:10 UTC |
| Received | 27 Oct 2026, 11:24:12 UTC |
| Server state | Over |
| Outcome | Success |
| Client state | Done |
| Exit status | 0 (0x00000000) |
| Computer ID | 628087 |
| Run time | 1 hours 11 min 13 sec |
| CPU time | 1 hours 11 min 13 sec |
| Validate state | Valid |
| Credit | 60,000.00 |
| Device peak FLOPS | 5,809.69 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 769.98 MB |
| Peak swap size | 12.94 GB |
| Peak disk usage | 3.03 GB |
Stderr output
<core_client_version>7.16.20</core_client_version>
<![CDATA[
<stderr_txt>
18:11:10 (4324): wrapper (7.9.26016): starting
18:11:10 (4324): 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
18:11:12 (4324): Library/usr/bin/tar.exe exited; CPU time 0.015625
18:11:12 (4324): 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:\BOINCPROJECT\slots\12\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 'D:\BOINCPROJECT\slots\12\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.
tar: run.log: file changed as we read it
tar: r*/*.dcd: Cannot stat: No such file or directory
tar: Exiting with failure status due to previous errors
19:23:18 (4324): C:/Windows/system32/cmd.exe exited; CPU time 4273.078125
19:23:18 (4324): called boinc_finish(0)
0 bytes in 0 Free Blocks.
176 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: 130163341 bytes.
Dumping objects ->
{3835668} normal block at 0x000002670A172490, 48 bytes long.
Data: <PATH=D:\BOINCPRO> 50 41 54 48 3D 44 3A 5C 42 4F 49 4E 43 50 52 4F
{3835657} normal block at 0x000002670C1C3710, 32 bytes long.
Data: <HOME=D:\BOINCPRO> 48 4F 4D 45 3D 44 3A 5C 42 4F 49 4E 43 50 52 4F
{3835646} normal block at 0x000002670C1C2C90, 32 bytes long.
Data: <TMP=D:\BOINCPROJ> 54 4D 50 3D 44 3A 5C 42 4F 49 4E 43 50 52 4F 4A
{3835635} normal block at 0x000002670C1C3770, 32 bytes long.
Data: <TEMP=D:\BOINCPRO> 54 45 4D 50 3D 44 3A 5C 42 4F 49 4E 43 50 52 4F
{3835624} normal block at 0x000002670C1C3830, 32 bytes long.
Data: <TMPDIR=D:\BOINCP> 54 4D 50 44 49 52 3D 44 3A 5C 42 4F 49 4E 43 50
{3835593} normal block at 0x000002670A1723B0, 48 bytes long.
Data: <PATH=D:\BOINCPRO> 50 41 54 48 3D 44 3A 5C 42 4F 49 4E 43 50 52 4F
..\api\boinc_api.cpp(309) : {3835580} normal block at 0x000002670A121B30, 8 bytes long.
Data: < g > 00 00 AE 0B 67 02 00 00
{3834085} normal block at 0x000002670A121D60, 8 bytes long.
Data: < g > 00 E6 10 0A 67 02 00 00
..\zip\boinc_zip.cpp(122) : {319} normal block at 0x000002670A11FB40, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{304} normal block at 0x000002670A1174A0, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
{303} normal block at 0x000002670A127BF0, 16 bytes long.
Data: <ht g > 68 74 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{302} normal block at 0x000002670A128280, 16 bytes long.
Data: <@t g > 40 74 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{301} normal block at 0x000002670A11E630, 32 bytes long.
Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D
{300} normal block at 0x000002670A127790, 16 bytes long.
Data: < t g > 18 74 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{299} normal block at 0x000002670A127740, 16 bytes long.
Data: < s g > F0 73 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{298} normal block at 0x000002670A127830, 16 bytes long.
Data: < s g > C8 73 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{297} normal block at 0x000002670A127D30, 16 bytes long.
Data: < s g > A0 73 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{296} normal block at 0x000002670A125390, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{295} normal block at 0x000002670A128320, 16 bytes long.
Data: < g > 18 12 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{294} normal block at 0x000002670A11ED50, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{293} normal block at 0x000002670A128500, 16 bytes long.
Data: < g > F0 11 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{291} normal block at 0x000002670A1279C0, 16 bytes long.
Data: < g > C8 11 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{290} normal block at 0x000002670A128410, 16 bytes long.
Data: < g > A0 11 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x000002670A127CE0, 16 bytes long.
Data: <x g > 78 11 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{288} normal block at 0x000002670A127BA0, 16 bytes long.
Data: <P g > 50 11 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x000002670A1283C0, 16 bytes long.
Data: <( g > 28 11 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{286} normal block at 0x000002670A11E930, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{285} normal block at 0x000002670A127600, 16 bytes long.
Data: < g > 00 11 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{284} normal block at 0x000002670A121100, 320 bytes long.
Data: < v g 0 g > 00 76 12 0A 67 02 00 00 30 E9 11 0A 67 02 00 00
{283} normal block at 0x000002670A128230, 16 bytes long.
Data: < s g > 80 73 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x000002670A127970, 16 bytes long.
Data: <Xs g > 58 73 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x000002670A11EC90, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{280} normal block at 0x000002670A128370, 16 bytes long.
Data: <0s g > 30 73 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x000002670A11F410, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{278} normal block at 0x000002670A127B50, 16 bytes long.
Data: <xr g > 78 72 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x000002670A127D80, 16 bytes long.
Data: <Pr g > 50 72 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{276} normal block at 0x000002670A1280A0, 16 bytes long.
Data: <(r g > 28 72 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x000002670A127A60, 16 bytes long.
Data: < r g > 00 72 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{274} normal block at 0x000002670A127C90, 16 bytes long.
Data: < q g > D8 71 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{273} normal block at 0x000002670A121D10, 16 bytes long.
Data: < q g > B0 71 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{271} normal block at 0x000002670A121EA0, 16 bytes long.
Data: <pT g > 70 54 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{270} normal block at 0x000002670A125470, 40 bytes long.
Data: < g # g > A0 1E 12 0A 67 02 00 00 B0 23 17 0A 67 02 00 00
{269} normal block at 0x000002670A121CC0, 16 bytes long.
Data: < q g > 90 71 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{268} normal block at 0x000002670A121C70, 16 bytes long.
Data: <hq g > 68 71 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x000002670A11F0B0, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{266} normal block at 0x000002670A121BD0, 16 bytes long.
Data: <@q g > 40 71 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{265} normal block at 0x000002670A127140, 992 bytes long.
Data: < g g > D0 1B 12 0A 67 02 00 00 B0 F0 11 0A 67 02 00 00
{101} normal block at 0x000002670A11E750, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{100} normal block at 0x000002670A122440, 16 bytes long.
Data: < Z g > 90 5A 12 0A 67 02 00 00 00 00 00 00 00 00 00 00
{99} normal block at 0x000002670A125A90, 40 bytes long.
Data: <@$ g P g > 40 24 12 0A 67 02 00 00 50 E7 11 0A 67 02 00 00
{76} normal block at 0x000002670A122760, 16 bytes long.
Data: < : > 80 EA F6 3A F6 7F 00 00 00 00 00 00 00 00 00 00
{75} normal block at 0x000002670A1229E0, 16 bytes long.
Data: <@ : > 40 E9 F6 3A F6 7F 00 00 00 00 00 00 00 00 00 00
{74} normal block at 0x000002670A122580, 16 bytes long.
Data: < W : > F8 57 F3 3A F6 7F 00 00 00 00 00 00 00 00 00 00
{73} normal block at 0x000002670A122940, 16 bytes long.
Data: < W : > D8 57 F3 3A F6 7F 00 00 00 00 00 00 00 00 00 00
{72} normal block at 0x000002670A122670, 16 bytes long.
Data: <P : > 50 04 F3 3A F6 7F 00 00 00 00 00 00 00 00 00 00
{71} normal block at 0x000002670A122300, 16 bytes long.
Data: <0 : > 30 04 F3 3A F6 7F 00 00 00 00 00 00 00 00 00 00
{70} normal block at 0x000002670A1222B0, 16 bytes long.
Data: < : > E0 02 F3 3A F6 7F 00 00 00 00 00 00 00 00 00 00
{69} normal block at 0x000002670A1228A0, 16 bytes long.
Data: < : > 10 04 F3 3A F6 7F 00 00 00 00 00 00 00 00 00 00
{68} normal block at 0x000002670A1220D0, 16 bytes long.
Data: <p : > 70 04 F3 3A F6 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x000002670A122620, 16 bytes long.
Data: < : > 18 C0 F1 3A F6 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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