Task 38699716
| Name | test_474-GPUGRID_TEST_ATM_40STEP_20261023-27-40-RND8718_0 |
| Workunit | 31640092 |
| Created | 5 Nov 2026, 7:16:34 UTC |
| Sent | 5 Nov 2026, 7:16:36 UTC |
| Report deadline | 10 Nov 2026, 7:16:36 UTC |
| Received | 5 Nov 2026, 7:44:33 UTC |
| Server state | Over |
| Outcome | Success |
| Client state | Done |
| Exit status | 0 (0x00000000) |
| Computer ID | 578932 |
| Run time | 24 min 55 sec |
| CPU time | 23 min 45 sec |
| Validate state | Valid |
| Credit | 60,000.00 |
| Device peak FLOPS | 34,102.83 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 718.98 MB |
| Peak swap size | 10.01 GB |
| Peak disk usage | 3.03 GB |
Stderr output
<core_client_version>8.2.11</core_client_version>
<![CDATA[
<stderr_txt>
07:20:11 (52924): wrapper (7.9.26016): starting
07:20:11 (52924): 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
07:20:12 (52924): Library/usr/bin/tar.exe exited; CPU time 0.000000
07:20:12 (52924): 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:\BOINC\slots\6\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:\BOINC\slots\6\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
07:44:06 (52924): C:/Windows/system32/cmd.exe exited; CPU time 1425.968750
07:44:06 (52924): 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: 36464195 bytes.
Dumping objects ->
{3835293} normal block at 0x00000297C6B88A20, 48 bytes long.
Data: <PATH=D:\BOINC\sl> 50 41 54 48 3D 44 3A 5C 42 4F 49 4E 43 5C 73 6C
{3835282} normal block at 0x00000297C881A520, 32 bytes long.
Data: <HOME=D:\BOINC\sl> 48 4F 4D 45 3D 44 3A 5C 42 4F 49 4E 43 5C 73 6C
{3835271} normal block at 0x00000297C881B1E0, 32 bytes long.
Data: <TMP=D:\BOINC\slo> 54 4D 50 3D 44 3A 5C 42 4F 49 4E 43 5C 73 6C 6F
{3835260} normal block at 0x00000297C881AE20, 32 bytes long.
Data: <TEMP=D:\BOINC\sl> 54 45 4D 50 3D 44 3A 5C 42 4F 49 4E 43 5C 73 6C
{3835249} normal block at 0x00000297C881B360, 32 bytes long.
Data: <TMPDIR=D:\BOINC\> 54 4D 50 44 49 52 3D 44 3A 5C 42 4F 49 4E 43 5C
{3835218} normal block at 0x00000297C6B892E0, 48 bytes long.
Data: <PATH=D:\BOINC\sl> 50 41 54 48 3D 44 3A 5C 42 4F 49 4E 43 5C 73 6C
..\api\boinc_api.cpp(309) : {3835205} normal block at 0x00000297C6B79F40, 8 bytes long.
Data: < ´Æ— > 00 00 B4 C6 97 02 00 00
{3833998} normal block at 0x00000297C6B7A3A0, 8 bytes long.
Data: < |‚È— > 10 7C 82 C8 97 02 00 00
..\zip\boinc_zip.cpp(122) : {328} normal block at 0x00000297C6B86100, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{313} normal block at 0x00000297C6B87180, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
{312} normal block at 0x00000297C6B881D0, 16 bytes long.
Data: < ‡¸Æ— > 18 87 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{311} normal block at 0x00000297C6B877D0, 16 bytes long.
Data: <ð†¸Æ— > F0 86 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{310} normal block at 0x00000297C6B7FC40, 32 bytes long.
Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D
{309} normal block at 0x00000297C6B87AF0, 16 bytes long.
Data: <Ȇ¸Æ— > C8 86 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{308} normal block at 0x00000297C6B88180, 16 bytes long.
Data: < †¸Æ— > A0 86 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{307} normal block at 0x00000297C6B88130, 16 bytes long.
Data: <x†¸Æ— > 78 86 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{306} normal block at 0x00000297C6B87B90, 16 bytes long.
Data: <P†¸Æ— > 50 86 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{305} normal block at 0x00000297C6B88E10, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{304} normal block at 0x00000297C6B87F00, 16 bytes long.
Data: < q¸Æ— > 18 71 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{303} normal block at 0x00000297C6B809C0, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{302} normal block at 0x00000297C6B87A50, 16 bytes long.
Data: <ðp¸Æ— > F0 70 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{300} normal block at 0x00000297C6B88040, 16 bytes long.
Data: <Èp¸Æ— > C8 70 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{299} normal block at 0x00000297C6B87780, 16 bytes long.
Data: < p¸Æ— > A0 70 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{298} normal block at 0x00000297C6B87EB0, 16 bytes long.
Data: <xp¸Æ— > 78 70 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{297} normal block at 0x00000297C6B87FA0, 16 bytes long.
Data: <Pp¸Æ— > 50 70 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{296} normal block at 0x00000297C6B878C0, 16 bytes long.
Data: <(p¸Æ— > 28 70 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{295} normal block at 0x00000297C6B802A0, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{294} normal block at 0x00000297C6B87730, 16 bytes long.
Data: < p¸Æ— > 00 70 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{293} normal block at 0x00000297C6B87000, 320 bytes long.
Data: <0w¸Æ—   ¸Æ— > 30 77 B8 C6 97 02 00 00 A0 02 B8 C6 97 02 00 00
{292} normal block at 0x00000297C6B87E60, 16 bytes long.
Data: <0†¸Æ— > 30 86 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{291} normal block at 0x00000297C6B87550, 16 bytes long.
Data: < †¸Æ— > 08 86 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{290} normal block at 0x00000297C6B80180, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{289} normal block at 0x00000297C6B87820, 16 bytes long.
Data: <à…¸Æ— > E0 85 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{288} normal block at 0x00000297C6B7FD60, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{287} normal block at 0x00000297C6B87D70, 16 bytes long.
Data: <(…¸Æ— > 28 85 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{286} normal block at 0x00000297C6B879B0, 16 bytes long.
Data: < …¸Æ— > 00 85 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{285} normal block at 0x00000297C6B87C30, 16 bytes long.
Data: <Ø„¸Æ— > D8 84 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{284} normal block at 0x00000297C6B874B0, 16 bytes long.
Data: <°„¸Æ— > B0 84 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{283} normal block at 0x00000297C6B876E0, 16 bytes long.
Data: < „¸Æ— > 88 84 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x00000297C6B87CD0, 16 bytes long.
Data: <`„¸Æ— > 60 84 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x00000297C6B873C0, 16 bytes long.
Data: <°‰¸Æ— > B0 89 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x00000297C6B889B0, 40 bytes long.
Data: <Às¸Æ— à’¸Æ— > C0 73 B8 C6 97 02 00 00 E0 92 B8 C6 97 02 00 00
{278} normal block at 0x00000297C6B87A00, 16 bytes long.
Data: <@„¸Æ— > 40 84 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x00000297C6B87C80, 16 bytes long.
Data: < „¸Æ— > 18 84 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{276} normal block at 0x00000297C6B7FEE0, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{275} normal block at 0x00000297C6B87460, 16 bytes long.
Data: <ðƒ¸Æ— > F0 83 B8 C6 97 02 00 00 00 00 00 00 00 00 00 00
{274} normal block at 0x00000297C6B883F0, 992 bytes long.
Data: <`t¸Æ— àþ·Æ— > 60 74 B8 C6 97 02 00 00 E0 FE B7 C6 97 02 00 00
{110} normal block at 0x00000297C6B80360, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{109} normal block at 0x00000297C6B79EF0, 16 bytes long.
Data: <°ô·Æ— > B0 F4 B7 C6 97 02 00 00 00 00 00 00 00 00 00 00
{108} normal block at 0x00000297C6B7F4B0, 40 bytes long.
Data: <ðž·Æ— ` ¸Æ— > F0 9E B7 C6 97 02 00 00 60 03 B8 C6 97 02 00 00
{87} normal block at 0x00000297C6B7A210, 16 bytes long.
Data: < ê*ó÷ > 80 EA 2A F3 F7 7F 00 00 00 00 00 00 00 00 00 00
{86} normal block at 0x00000297C6B799F0, 16 bytes long.
Data: <@é*ó÷ > 40 E9 2A F3 F7 7F 00 00 00 00 00 00 00 00 00 00
{85} normal block at 0x00000297C6B79630, 16 bytes long.
Data: <øW'ó÷ > F8 57 27 F3 F7 7F 00 00 00 00 00 00 00 00 00 00
{84} normal block at 0x00000297C6B7A300, 16 bytes long.
Data: <ØW'ó÷ > D8 57 27 F3 F7 7F 00 00 00 00 00 00 00 00 00 00
{83} normal block at 0x00000297C6B79E50, 16 bytes long.
Data: <P 'ó÷ > 50 04 27 F3 F7 7F 00 00 00 00 00 00 00 00 00 00
{82} normal block at 0x00000297C6B7A170, 16 bytes long.
Data: <0 'ó÷ > 30 04 27 F3 F7 7F 00 00 00 00 00 00 00 00 00 00
{81} normal block at 0x00000297C6B79BD0, 16 bytes long.
Data: <à 'ó÷ > E0 02 27 F3 F7 7F 00 00 00 00 00 00 00 00 00 00
{80} normal block at 0x00000297C6B7A4E0, 16 bytes long.
Data: < 'ó÷ > 10 04 27 F3 F7 7F 00 00 00 00 00 00 00 00 00 00
{79} normal block at 0x00000297C6B797C0, 16 bytes long.
Data: <p 'ó÷ > 70 04 27 F3 F7 7F 00 00 00 00 00 00 00 00 00 00
{78} normal block at 0x00000297C6B7A0D0, 16 bytes long.
Data: < À%ó÷ > 18 C0 25 F3 F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
©2026 Universitat Pompeu Fabra