Task 38682571
| Name | test_869-GPUGRID_TEST_ATM_40STEP_20261023-28-40-RND4179_0 |
| Workunit | 31624175 |
| Created | 27 Oct 2026, 8:15:39 UTC |
| Sent | 27 Oct 2026, 8:15:43 UTC |
| Report deadline | 1 Nov 2026, 8:15:43 UTC |
| Received | 27 Oct 2026, 8:46:46 UTC |
| Server state | Over |
| Outcome | Success |
| Client state | Done |
| Exit status | 0 (0x00000000) |
| Computer ID | 523908 |
| Run time | 30 min 7 sec |
| CPU time | 28 min 25 sec |
| Validate state | Valid |
| Credit | 60,000.00 |
| Device peak FLOPS | 56,279.60 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 742.71 MB |
| Peak swap size | 13.04 GB |
| Peak disk usage | 3.03 GB |
Stderr output
<core_client_version>8.2.9</core_client_version>
<![CDATA[
<stderr_txt>
09:16:40 (10772): wrapper (7.9.26016): starting
09:16:40 (10772): 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
09:16:41 (10772): Library/usr/bin/tar.exe exited; CPU time 0.000000
09:16:41 (10772): 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
09:46:01 (10772): C:/Windows/system32/cmd.exe exited; CPU time 1705.750000
09:46:01 (10772): 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: 22995747 bytes.
Dumping objects ->
{3835235} normal block at 0x000002553268F310, 48 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835224} normal block at 0x000002553268FE00, 48 bytes long.
Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835213} normal block at 0x000002553268FD90, 48 bytes long.
Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61
{3835202} normal block at 0x000002553268F7E0, 48 bytes long.
Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835191} normal block at 0x0000025530A74A80, 48 bytes long.
Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61
{3835160} normal block at 0x0000025532706980, 64 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835149} normal block at 0x000002553271E420, 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) : {3835146} normal block at 0x0000025530A6F0A0, 8 bytes long.
Data: < £0U > 00 00 A3 30 55 02 00 00
{3834542} normal block at 0x000002553271EF20, 102 bytes long.
Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65
{3833961} normal block at 0x0000025530A6EE20, 8 bytes long.
Data: < 8v2U > 80 38 76 32 55 02 00 00
..\zip\boinc_zip.cpp(122) : {312} normal block at 0x0000025530A70D50, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{297} normal block at 0x0000025530A66AF0, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
{296} normal block at 0x0000025530A75AB0, 16 bytes long.
Data: <hf§0U > 68 66 A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{295} normal block at 0x0000025530A75470, 16 bytes long.
Data: <@f§0U > 40 66 A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{294} normal block at 0x0000025530A70140, 32 bytes long.
Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D
{293} normal block at 0x0000025530A75FB0, 16 bytes long.
Data: < f§0U > 18 66 A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x0000025530A75510, 16 bytes long.
Data: <ðe§0U > F0 65 A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{291} normal block at 0x0000025530A75920, 16 bytes long.
Data: <Èe§0U > C8 65 A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{290} normal block at 0x0000025530A75650, 16 bytes long.
Data: < e§0U > A0 65 A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x0000025530A74930, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{288} normal block at 0x0000025530A76230, 16 bytes long.
Data: <Xç¦0U > 58 E7 A6 30 55 02 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x0000025530A70320, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{286} normal block at 0x0000025530A75B50, 16 bytes long.
Data: <0ç¦0U > 30 E7 A6 30 55 02 00 00 00 00 00 00 00 00 00 00
{284} normal block at 0x0000025530A75420, 16 bytes long.
Data: < ç¦0U > 08 E7 A6 30 55 02 00 00 00 00 00 00 00 00 00 00
{283} normal block at 0x0000025530A75970, 16 bytes long.
Data: <àæ¦0U > E0 E6 A6 30 55 02 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x0000025530A75600, 16 bytes long.
Data: <¸æ¦0U > B8 E6 A6 30 55 02 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x0000025530A758D0, 16 bytes long.
Data: < æ¦0U > 90 E6 A6 30 55 02 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x0000025530A75F10, 16 bytes long.
Data: <hæ¦0U > 68 E6 A6 30 55 02 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x0000025530A70260, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{278} normal block at 0x0000025530A75C40, 16 bytes long.
Data: <@æ¦0U > 40 E6 A6 30 55 02 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x0000025530A6E640, 320 bytes long.
Data: <@\§0U ` §0U > 40 5C A7 30 55 02 00 00 60 02 A7 30 55 02 00 00
{276} normal block at 0x0000025530A755B0, 16 bytes long.
Data: < e§0U > 80 65 A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x0000025530A753D0, 16 bytes long.
Data: <Xe§0U > 58 65 A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{274} normal block at 0x0000025530A70740, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{273} normal block at 0x0000025530A760A0, 16 bytes long.
Data: <0e§0U > 30 65 A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{272} normal block at 0x0000025530A6FD80, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{271} normal block at 0x0000025530A76000, 16 bytes long.
Data: <xd§0U > 78 64 A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{270} normal block at 0x0000025530A75CE0, 16 bytes long.
Data: <Pd§0U > 50 64 A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{269} normal block at 0x0000025530A75B00, 16 bytes long.
Data: <(d§0U > 28 64 A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{268} normal block at 0x0000025530A76190, 16 bytes long.
Data: < d§0U > 00 64 A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x0000025530A75A60, 16 bytes long.
Data: <Øc§0U > D8 63 A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x0000025530A75E70, 16 bytes long.
Data: <°c§0U > B0 63 A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{264} normal block at 0x0000025530A756A0, 16 bytes long.
Data: <ðJ§0U > F0 4A A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{263} normal block at 0x0000025530A74AF0, 40 bytes long.
Data: < V§0U ip2U > A0 56 A7 30 55 02 00 00 80 69 70 32 55 02 00 00
{262} normal block at 0x0000025530A759C0, 16 bytes long.
Data: < c§0U > 90 63 A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{261} normal block at 0x0000025530A75880, 16 bytes long.
Data: <hc§0U > 68 63 A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{260} normal block at 0x0000025530A70200, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{259} normal block at 0x0000025530A75830, 16 bytes long.
Data: <@c§0U > 40 63 A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{258} normal block at 0x0000025530A76340, 992 bytes long.
Data: <0X§0U §0U > 30 58 A7 30 55 02 00 00 00 02 A7 30 55 02 00 00
{94} normal block at 0x0000025530A70440, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{93} normal block at 0x0000025530A6F460, 16 bytes long.
Data: < M§0U > 20 4D A7 30 55 02 00 00 00 00 00 00 00 00 00 00
{92} normal block at 0x0000025530A74D20, 40 bytes long.
Data: <`ô¦0U @ §0U > 60 F4 A6 30 55 02 00 00 40 04 A7 30 55 02 00 00
{71} normal block at 0x0000025530A6E830, 16 bytes long.
Data: < êÌ ÷ > 80 EA CC 20 F7 7F 00 00 00 00 00 00 00 00 00 00
{70} normal block at 0x0000025530A6F5F0, 16 bytes long.
Data: <@éÌ ÷ > 40 E9 CC 20 F7 7F 00 00 00 00 00 00 00 00 00 00
{69} normal block at 0x0000025530A6F370, 16 bytes long.
Data: <øWÉ ÷ > F8 57 C9 20 F7 7F 00 00 00 00 00 00 00 00 00 00
{68} normal block at 0x0000025530A6F410, 16 bytes long.
Data: <ØWÉ ÷ > D8 57 C9 20 F7 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x0000025530A6F2D0, 16 bytes long.
Data: <P É ÷ > 50 04 C9 20 F7 7F 00 00 00 00 00 00 00 00 00 00
{66} normal block at 0x0000025530A6F230, 16 bytes long.
Data: <0 É ÷ > 30 04 C9 20 F7 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x0000025530A6F730, 16 bytes long.
Data: <à É ÷ > E0 02 C9 20 F7 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x0000025530A6ECE0, 16 bytes long.
Data: < É ÷ > 10 04 C9 20 F7 7F 00 00 00 00 00 00 00 00 00 00
{63} normal block at 0x0000025530A6F780, 16 bytes long.
Data: <p É ÷ > 70 04 C9 20 F7 7F 00 00 00 00 00 00 00 00 00 00
{62} normal block at 0x0000025530A6EF60, 16 bytes long.
Data: < ÀÇ ÷ > 18 C0 C7 20 F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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