Task 38685667
| Name | test_302-GPUGRID_TEST_ATM_40STEP_20261023-16-40-RND8270_0 |
| Workunit | 31627128 |
| Created | 27 Oct 2026, 22:19:29 UTC |
| Sent | 27 Oct 2026, 22:19:44 UTC |
| Report deadline | 1 Nov 2026, 22:19:44 UTC |
| Received | 28 Oct 2026, 4:32:15 UTC |
| Server state | Over |
| Outcome | Success |
| Client state | Done |
| Exit status | 0 (0x00000000) |
| Computer ID | 647027 |
| Run time | 1 hours 13 min 29 sec |
| CPU time | 1 hours 10 min 31 sec |
| Validate state | Valid |
| Credit | 60,000.00 |
| Device peak FLOPS | 6,809.63 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 698.27 MB |
| Peak swap size | 12.87 GB |
| Peak disk usage | 3.40 GB |
Stderr output
<core_client_version>8.2.4</core_client_version>
<![CDATA[
<stderr_txt>
04:20:16 (9612): wrapper (7.9.26016): starting
04:20:16 (9612): 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
04:20:18 (9612): Library/usr/bin/tar.exe exited; CPU time 0.000000
04:20:18 (9612): 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\24\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\24\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
05:31:16 (9612): C:/Windows/system32/cmd.exe exited; CPU time 4231.703125
05:31:16 (9612): called boinc_finish(0)
0 bytes in 0 Free Blocks.
546 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: 55989033 bytes.
Dumping objects ->
{3835251} normal block at 0x0000021FA83B0A00, 48 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835240} normal block at 0x0000021FA83B0B50, 48 bytes long.
Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835229} normal block at 0x0000021FA83B1480, 48 bytes long.
Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61
{3835218} normal block at 0x0000021FA83B0DF0, 48 bytes long.
Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835207} normal block at 0x0000021FA83B0E60, 48 bytes long.
Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61
{3835176} normal block at 0x0000021FA84A51F0, 64 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835165} normal block at 0x0000021FA83BD010, 145 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) : {3835162} normal block at 0x0000021FA69285B0, 8 bytes long.
Data: < ¨ > 00 00 1C A8 1F 02 00 00
{3834552} normal block at 0x0000021FA83BE7A0, 145 bytes long.
Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65
{3833949} normal block at 0x0000021FA69289C0, 8 bytes long.
Data: <0XS¨ > 30 58 53 A8 1F 02 00 00
..\zip\boinc_zip.cpp(122) : {306} normal block at 0x0000021FA6932930, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{291} normal block at 0x0000021FA6915C40, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
{290} normal block at 0x0000021FA6933DD0, 16 bytes long.
Data: <hK“¦ > 68 4B 93 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x0000021FA6933F60, 16 bytes long.
Data: <@K“¦ > 40 4B 93 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{288} normal block at 0x0000021FA692DEB0, 32 bytes long.
Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D
{287} normal block at 0x0000021FA6933D80, 16 bytes long.
Data: < K“¦ > 18 4B 93 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{286} normal block at 0x0000021FA6934780, 16 bytes long.
Data: <ðJ“¦ > F0 4A 93 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{285} normal block at 0x0000021FA6933D30, 16 bytes long.
Data: <ÈJ“¦ > C8 4A 93 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{284} normal block at 0x0000021FA6933C40, 16 bytes long.
Data: < J“¦ > A0 4A 93 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{283} normal block at 0x0000021FA692CAC0, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{282} normal block at 0x0000021FA6933A60, 16 bytes long.
Data: <Ø[‘¦ > D8 5B 91 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x0000021FA692E1B0, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{280} normal block at 0x0000021FA6933AB0, 16 bytes long.
Data: <°[‘¦ > B0 5B 91 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{278} normal block at 0x0000021FA6933B00, 16 bytes long.
Data: < [‘¦ > 88 5B 91 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x0000021FA69343C0, 16 bytes long.
Data: <`[‘¦ > 60 5B 91 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{276} normal block at 0x0000021FA6933CE0, 16 bytes long.
Data: <8[‘¦ > 38 5B 91 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x0000021FA69344B0, 16 bytes long.
Data: < [‘¦ > 10 5B 91 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{274} normal block at 0x0000021FA6933BF0, 16 bytes long.
Data: <èZ‘¦ > E8 5A 91 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{273} normal block at 0x0000021FA692EC90, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{272} normal block at 0x0000021FA6934230, 16 bytes long.
Data: <ÀZ‘¦ > C0 5A 91 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{271} normal block at 0x0000021FA6915AC0, 320 bytes long.
Data: <0B“¦ ì’¦ > 30 42 93 A6 1F 02 00 00 90 EC 92 A6 1F 02 00 00
{270} normal block at 0x0000021FA6933B50, 16 bytes long.
Data: < J“¦ > 80 4A 93 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{269} normal block at 0x0000021FA6934640, 16 bytes long.
Data: <XJ“¦ > 58 4A 93 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{268} normal block at 0x0000021FA692EC30, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{267} normal block at 0x0000021FA6933F10, 16 bytes long.
Data: <0J“¦ > 30 4A 93 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x0000021FA692E5D0, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{265} normal block at 0x0000021FA69339C0, 16 bytes long.
Data: <xI“¦ > 78 49 93 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{264} normal block at 0x0000021FA69347D0, 16 bytes long.
Data: <PI“¦ > 50 49 93 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{263} normal block at 0x0000021FA6933920, 16 bytes long.
Data: <(I“¦ > 28 49 93 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{262} normal block at 0x0000021FA6934730, 16 bytes long.
Data: < I“¦ > 00 49 93 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{261} normal block at 0x0000021FA6934280, 16 bytes long.
Data: <ØH“¦ > D8 48 93 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{260} normal block at 0x0000021FA6933A10, 16 bytes long.
Data: <°H“¦ > B0 48 93 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{258} normal block at 0x0000021FA6934140, 16 bytes long.
Data: < Ï’¦ > 90 CF 92 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{257} normal block at 0x0000021FA692CF90, 40 bytes long.
Data: <@A“¦ ðQJ¨ > 40 41 93 A6 1F 02 00 00 F0 51 4A A8 1F 02 00 00
{256} normal block at 0x0000021FA6933E20, 16 bytes long.
Data: < H“¦ > 90 48 93 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{255} normal block at 0x0000021FA6934690, 16 bytes long.
Data: <hH“¦ > 68 48 93 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{254} normal block at 0x0000021FA692E870, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{253} normal block at 0x0000021FA6933970, 16 bytes long.
Data: <@H“¦ > 40 48 93 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{252} normal block at 0x0000021FA6934840, 992 bytes long.
Data: <p9“¦ pè’¦ > 70 39 93 A6 1F 02 00 00 70 E8 92 A6 1F 02 00 00
{88} normal block at 0x0000021FA692E3F0, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{87} normal block at 0x0000021FA6928060, 16 bytes long.
Data: < Ë’¦ > A0 CB 92 A6 1F 02 00 00 00 00 00 00 00 00 00 00
{86} normal block at 0x0000021FA692CBA0, 40 bytes long.
Data: <` ’¦ ðã’¦ > 60 80 92 A6 1F 02 00 00 F0 E3 92 A6 1F 02 00 00
{65} normal block at 0x0000021FA6927ED0, 16 bytes long.
Data: < êôµö > 80 EA F4 B5 F6 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x0000021FA6928A60, 16 bytes long.
Data: <@éôµö > 40 E9 F4 B5 F6 7F 00 00 00 00 00 00 00 00 00 00
{63} normal block at 0x0000021FA6927FC0, 16 bytes long.
Data: <øWñµö > F8 57 F1 B5 F6 7F 00 00 00 00 00 00 00 00 00 00
{62} normal block at 0x0000021FA6927D40, 16 bytes long.
Data: <ØWñµö > D8 57 F1 B5 F6 7F 00 00 00 00 00 00 00 00 00 00
{61} normal block at 0x0000021FA6927CF0, 16 bytes long.
Data: <P ñµö > 50 04 F1 B5 F6 7F 00 00 00 00 00 00 00 00 00 00
{60} normal block at 0x0000021FA6928650, 16 bytes long.
Data: <0 ñµö > 30 04 F1 B5 F6 7F 00 00 00 00 00 00 00 00 00 00
{59} normal block at 0x0000021FA6928920, 16 bytes long.
Data: <à ñµö > E0 02 F1 B5 F6 7F 00 00 00 00 00 00 00 00 00 00
{58} normal block at 0x0000021FA6928970, 16 bytes long.
Data: < ñµö > 10 04 F1 B5 F6 7F 00 00 00 00 00 00 00 00 00 00
{57} normal block at 0x0000021FA6927F20, 16 bytes long.
Data: <p ñµö > 70 04 F1 B5 F6 7F 00 00 00 00 00 00 00 00 00 00
{56} normal block at 0x0000021FA6927CA0, 16 bytes long.
Data: < Àïµö > 18 C0 EF B5 F6 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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