Task 38682952
| Name | test_185-GPUGRID_TEST_ATM_40STEP_20261023-27-40-RND9325_0 |
| Workunit | 31624543 |
| Created | 27 Oct 2026, 9:48:52 UTC |
| Sent | 27 Oct 2026, 9:49:05 UTC |
| Report deadline | 1 Nov 2026, 9:49:05 UTC |
| Received | 27 Oct 2026, 11:58:02 UTC |
| Server state | Over |
| Outcome | Success |
| Client state | Done |
| Exit status | 0 (0x00000000) |
| Computer ID | 613000 |
| Run time | 1 hours 2 min 21 sec |
| CPU time | 1 hours 2 min 21 sec |
| Validate state | Valid |
| Credit | 60,000.00 |
| Device peak FLOPS | 3,094.79 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 623.35 MB |
| Peak swap size | 2.17 GB |
| Peak disk usage | 3.03 GB |
Stderr output
<core_client_version>8.2.4</core_client_version>
<![CDATA[
<stderr_txt>
16:56:28 (21496): wrapper (7.9.26016): starting
16:56:29 (21496): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
17:10:28 (10796): wrapper (7.9.26016): starting
17:10:28 (10796): 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
17:10:32 (10796): Library/usr/bin/tar.exe exited; CPU time 0.015625
17:10:32 (10796): 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\2\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\2\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: r*/*.xtc: Cannot stat: No such file or directory
tar: Exiting with failure status due to previous errors
18:54:32 (10796): C:/Windows/system32/cmd.exe exited; CPU time 3741.718750
18:54:32 (10796): called boinc_finish(0)
0 bytes in 0 Free Blocks.
256 bytes in 6 Normal Blocks.
2288 bytes in 2 CRT Blocks.
0 bytes in 0 Ignore Blocks.
0 bytes in 0 Client Blocks.
Largest number used: 0 bytes.
Total allocations: 117048043 bytes.
Dumping objects ->
{1559} normal block at 0x00000219C516E350, 48 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{1548} normal block at 0x00000219C516E660, 48 bytes long.
Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{1537} normal block at 0x00000219C516EA50, 48 bytes long.
Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61
{1526} normal block at 0x00000219C516E890, 48 bytes long.
Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{1515} normal block at 0x00000219C516E5F0, 48 bytes long.
Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61
{1484} normal block at 0x00000219C515C910, 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) : {1471} normal block at 0x00000219C5174120, 8 bytes long.
Data: < > 00 00 9F C6 19 02 00 00
{306} normal block at 0x00000219C5174580, 8 bytes long.
Data: < r > 10 72 17 C5 19 02 00 00
{298} normal block at 0x00000219C5173760, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
{297} normal block at 0x00000219C51739A0, 16 bytes long.
Data: < a > 08 61 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{296} normal block at 0x00000219C5174210, 16 bytes long.
Data: < ` > E0 60 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{295} normal block at 0x00000219C516D520, 32 bytes long.
Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D
{294} normal block at 0x00000219C5174030, 16 bytes long.
Data: < ` > B8 60 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{293} normal block at 0x00000219C5173FE0, 16 bytes long.
Data: < ` > 90 60 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x00000219C51743F0, 16 bytes long.
Data: <h` > 68 60 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{291} normal block at 0x00000219C5173950, 16 bytes long.
Data: <@` > 40 60 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{290} normal block at 0x00000219C516E7B0, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{289} normal block at 0x00000219C5173900, 16 bytes long.
Data: < 6 > F8 36 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{288} normal block at 0x00000219C516DE20, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{287} normal block at 0x00000219C5174170, 16 bytes long.
Data: < 6 > D0 36 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{285} normal block at 0x00000219C5173EA0, 16 bytes long.
Data: < 6 > A8 36 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{284} normal block at 0x00000219C5173DB0, 16 bytes long.
Data: < 6 > 80 36 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{283} normal block at 0x00000219C5174670, 16 bytes long.
Data: <X6 > 58 36 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x00000219C5173B30, 16 bytes long.
Data: <06 > 30 36 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x00000219C5173E50, 16 bytes long.
Data: < 6 > 08 36 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x00000219C516D5E0, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{279} normal block at 0x00000219C5173F90, 16 bytes long.
Data: < 5 > E0 35 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{278} normal block at 0x00000219C51735E0, 320 bytes long.
Data: < ? > 90 3F 17 C5 19 02 00 00 E0 D5 16 C5 19 02 00 00
{277} normal block at 0x00000219C5174530, 16 bytes long.
Data: < ` > 20 60 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{276} normal block at 0x00000219C51740D0, 16 bytes long.
Data: < _ > F8 5F 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x00000219C516D820, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{274} normal block at 0x00000219C5173F40, 16 bytes long.
Data: < _ > D0 5F 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{273} normal block at 0x00000219C516D640, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{272} normal block at 0x00000219C5174080, 16 bytes long.
Data: < _ > 18 5F 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{271} normal block at 0x00000219C51742B0, 16 bytes long.
Data: < ^ > F0 5E 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{270} normal block at 0x00000219C5173AE0, 16 bytes long.
Data: < ^ > C8 5E 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{269} normal block at 0x00000219C5173D60, 16 bytes long.
Data: < ^ > A0 5E 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{268} normal block at 0x00000219C51743A0, 16 bytes long.
Data: <x^ > 78 5E 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x00000219C51747B0, 16 bytes long.
Data: <P^ > 50 5E 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{265} normal block at 0x00000219C5174710, 16 bytes long.
Data: < > 00 E9 16 C5 19 02 00 00 00 00 00 00 00 00 00 00
{264} normal block at 0x00000219C516E900, 40 bytes long.
Data: < G > 10 47 17 C5 19 02 00 00 10 C9 15 C5 19 02 00 00
{263} normal block at 0x00000219C5173E00, 16 bytes long.
Data: <0^ > 30 5E 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{262} normal block at 0x00000219C5173A90, 16 bytes long.
Data: < ^ > 08 5E 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{261} normal block at 0x00000219C516D3A0, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{260} normal block at 0x00000219C5173D10, 16 bytes long.
Data: < ] > E0 5D 17 C5 19 02 00 00 00 00 00 00 00 00 00 00
{259} normal block at 0x00000219C5175DE0, 992 bytes long.
Data: < = > 10 3D 17 C5 19 02 00 00 A0 D3 16 C5 19 02 00 00
{95} normal block at 0x00000219C516DDC0, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{94} normal block at 0x00000219C5169170, 16 bytes long.
Data: < > E0 E9 16 C5 19 02 00 00 00 00 00 00 00 00 00 00
{93} normal block at 0x00000219C516E9E0, 40 bytes long.
Data: <p > 70 91 16 C5 19 02 00 00 C0 DD 16 C5 19 02 00 00
{72} normal block at 0x00000219C5168DB0, 16 bytes long.
Data: < c > 80 EA 63 D0 F7 7F 00 00 00 00 00 00 00 00 00 00
{71} normal block at 0x00000219C5168F90, 16 bytes long.
Data: <@ c > 40 E9 63 D0 F7 7F 00 00 00 00 00 00 00 00 00 00
{70} normal block at 0x00000219C5168C70, 16 bytes long.
Data: < W` > F8 57 60 D0 F7 7F 00 00 00 00 00 00 00 00 00 00
{69} normal block at 0x00000219C5168900, 16 bytes long.
Data: < W` > D8 57 60 D0 F7 7F 00 00 00 00 00 00 00 00 00 00
{68} normal block at 0x00000219C5169300, 16 bytes long.
Data: <P ` > 50 04 60 D0 F7 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x00000219C5168C20, 16 bytes long.
Data: <0 ` > 30 04 60 D0 F7 7F 00 00 00 00 00 00 00 00 00 00
{66} normal block at 0x00000219C51693A0, 16 bytes long.
Data: < ` > E0 02 60 D0 F7 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x00000219C5168950, 16 bytes long.
Data: < ` > 10 04 60 D0 F7 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x00000219C5168630, 16 bytes long.
Data: <p ` > 70 04 60 D0 F7 7F 00 00 00 00 00 00 00 00 00 00
{63} normal block at 0x00000219C5168D60, 16 bytes long.
Data: < ^ > 18 C0 5E D0 F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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