Task 38684602
| Name | test_321-GPUGRID_TEST_ATM_40STEP_20261023-19-40-RND3331_0 |
| Workunit | 31626110 |
| Created | 27 Oct 2026, 17:07:44 UTC |
| Sent | 27 Oct 2026, 17:07:50 UTC |
| Report deadline | 1 Nov 2026, 17:07:50 UTC |
| Received | 27 Oct 2026, 18:41:31 UTC |
| Server state | Over |
| Outcome | Success |
| Client state | Done |
| Exit status | 0 (0x00000000) |
| Computer ID | 628087 |
| Run time | 1 hours 23 min 2 sec |
| CPU time | 1 hours 23 min 2 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 | 738.22 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>
01:14:24 (79440): wrapper (7.9.26016): starting
01:14:24 (79440): 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
01:14:26 (79440): Library/usr/bin/tar.exe exited; CPU time 0.015625
01:14:26 (79440): 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\9\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\9\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
02:39:29 (79440): C:/Windows/system32/cmd.exe exited; CPU time 4982.125000
02:39:29 (79440): 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: 165668597 bytes.
Dumping objects ->
{3835668} normal block at 0x000001F3C4B03E00, 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 0x000001F3C6AC88C0, 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 0x000001F3C6AC8800, 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 0x000001F3C6AC8B60, 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 0x000001F3C6AC87A0, 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 0x000001F3C4B03AF0, 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 0x000001F3C4AB18A0, 8 bytes long.
Data: < > 00 00 A6 C4 F3 01 00 00
{3834085} normal block at 0x000001F3C4AB13F0, 8 bytes long.
Data: < > 80 EB B8 C4 F3 01 00 00
..\zip\boinc_zip.cpp(122) : {319} normal block at 0x000001F3C4AB2DB0, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{304} normal block at 0x000001F3C4AA7420, 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 0x000001F3C4AB7FD0, 16 bytes long.
Data: <hq > 68 71 AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{302} normal block at 0x000001F3C4AB8160, 16 bytes long.
Data: <@q > 40 71 AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{301} normal block at 0x000001F3C4AAF090, 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 0x000001F3C4AB7F30, 16 bytes long.
Data: < q > 18 71 AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{299} normal block at 0x000001F3C4AB8110, 16 bytes long.
Data: < p > F0 70 AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{298} normal block at 0x000001F3C4AB77B0, 16 bytes long.
Data: < p > C8 70 AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{297} normal block at 0x000001F3C4AB7760, 16 bytes long.
Data: < p > A0 70 AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{296} normal block at 0x000001F3C4AB5860, 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 0x000001F3C4AB7B70, 16 bytes long.
Data: < > B8 C3 A9 C4 F3 01 00 00 00 00 00 00 00 00 00 00
{294} normal block at 0x000001F3C4AAF270, 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 0x000001F3C4AB8200, 16 bytes long.
Data: < > 90 C3 A9 C4 F3 01 00 00 00 00 00 00 00 00 00 00
{291} normal block at 0x000001F3C4AB7B20, 16 bytes long.
Data: <h > 68 C3 A9 C4 F3 01 00 00 00 00 00 00 00 00 00 00
{290} normal block at 0x000001F3C4AB7490, 16 bytes long.
Data: <@ > 40 C3 A9 C4 F3 01 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x000001F3C4AB7D50, 16 bytes long.
Data: < > 18 C3 A9 C4 F3 01 00 00 00 00 00 00 00 00 00 00
{288} normal block at 0x000001F3C4AB74E0, 16 bytes long.
Data: < > F0 C2 A9 C4 F3 01 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x000001F3C4AB7440, 16 bytes long.
Data: < > C8 C2 A9 C4 F3 01 00 00 00 00 00 00 00 00 00 00
{286} normal block at 0x000001F3C4AAEA30, 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 0x000001F3C4AB78F0, 16 bytes long.
Data: < > A0 C2 A9 C4 F3 01 00 00 00 00 00 00 00 00 00 00
{284} normal block at 0x000001F3C4A9C2A0, 320 bytes long.
Data: < x 0 > F0 78 AB C4 F3 01 00 00 30 EA AA C4 F3 01 00 00
{283} normal block at 0x000001F3C4AB7EE0, 16 bytes long.
Data: < p > 80 70 AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x000001F3C4AB7E90, 16 bytes long.
Data: <Xp > 58 70 AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x000001F3C4AAF390, 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 0x000001F3C4AB7670, 16 bytes long.
Data: <0p > 30 70 AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x000001F3C4AAEE50, 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 0x000001F3C4AB7DF0, 16 bytes long.
Data: <xo > 78 6F AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x000001F3C4AB7E40, 16 bytes long.
Data: <Po > 50 6F AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{276} normal block at 0x000001F3C4AB7350, 16 bytes long.
Data: <(o > 28 6F AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x000001F3C4AB7C10, 16 bytes long.
Data: < o > 00 6F AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{274} normal block at 0x000001F3C4AB7710, 16 bytes long.
Data: < n > D8 6E AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{273} normal block at 0x000001F3C4AB21B0, 16 bytes long.
Data: < n > B0 6E AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{271} normal block at 0x000001F3C4AB1FD0, 16 bytes long.
Data: <PU > 50 55 AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{270} normal block at 0x000001F3C4AB5550, 40 bytes long.
Data: < : > D0 1F AB C4 F3 01 00 00 F0 3A B0 C4 F3 01 00 00
{269} normal block at 0x000001F3C4AB1F80, 16 bytes long.
Data: < n > 90 6E AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{268} normal block at 0x000001F3C4AB1CB0, 16 bytes long.
Data: <hn > 68 6E AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x000001F3C4AAED90, 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 0x000001F3C4AB1B70, 16 bytes long.
Data: <@n > 40 6E AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{265} normal block at 0x000001F3C4AB6E40, 992 bytes long.
Data: <p > 70 1B AB C4 F3 01 00 00 90 ED AA C4 F3 01 00 00
{101} normal block at 0x000001F3C4AAEDF0, 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 0x000001F3C4AB1530, 16 bytes long.
Data: < W > 10 57 AB C4 F3 01 00 00 00 00 00 00 00 00 00 00
{99} normal block at 0x000001F3C4AB5710, 40 bytes long.
Data: <0 > 30 15 AB C4 F3 01 00 00 F0 ED AA C4 F3 01 00 00
{76} normal block at 0x000001F3C4AB13A0, 16 bytes long.
Data: < :B > 80 EA 3A 42 F7 7F 00 00 00 00 00 00 00 00 00 00
{75} normal block at 0x000001F3C4AB1BC0, 16 bytes long.
Data: <@ :B > 40 E9 3A 42 F7 7F 00 00 00 00 00 00 00 00 00 00
{74} normal block at 0x000001F3C4AB17B0, 16 bytes long.
Data: < W7B > F8 57 37 42 F7 7F 00 00 00 00 00 00 00 00 00 00
{73} normal block at 0x000001F3C4AB1800, 16 bytes long.
Data: < W7B > D8 57 37 42 F7 7F 00 00 00 00 00 00 00 00 00 00
{72} normal block at 0x000001F3C4AB1260, 16 bytes long.
Data: <P 7B > 50 04 37 42 F7 7F 00 00 00 00 00 00 00 00 00 00
{71} normal block at 0x000001F3C4AB1760, 16 bytes long.
Data: <0 7B > 30 04 37 42 F7 7F 00 00 00 00 00 00 00 00 00 00
{70} normal block at 0x000001F3C4AB1C10, 16 bytes long.
Data: < 7B > E0 02 37 42 F7 7F 00 00 00 00 00 00 00 00 00 00
{69} normal block at 0x000001F3C4AB1D50, 16 bytes long.
Data: < 7B > 10 04 37 42 F7 7F 00 00 00 00 00 00 00 00 00 00
{68} normal block at 0x000001F3C4AB14E0, 16 bytes long.
Data: <p 7B > 70 04 37 42 F7 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x000001F3C4AB1850, 16 bytes long.
Data: < 5B > 18 C0 35 42 F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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