Task 38638984
| Name | cdk8_A02_A01_r0_4-QUICO_ATM_OpenFF23_NAGL_cdk8-3-6-RND2805_3 |
| Workunit | 31577591 |
| Created | 30 Apr 2026, 13:08:06 UTC |
| Sent | 30 Apr 2026, 13:08:14 UTC |
| Report deadline | 5 May 2026, 13:08:14 UTC |
| Received | 30 Apr 2026, 13:12:54 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 195 (0x000000C3) EXIT_CHILD_FAILED |
| Computer ID | 642172 |
| Run time | 2 min 20 sec |
| CPU time | 6 sec |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 8,885.53 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 39.55 MB |
| Peak swap size | 28.02 MB |
| Peak disk usage | 2.11 GB |
Stderr output
<core_client_version>8.2.9</core_client_version>
<![CDATA[
<message>
The operating system cannot run (null).
(0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
08:10:08 (50612): wrapper (7.9.26016): starting
08:10:08 (50612): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A02_A01_0.pdb
QB_A02_A01_0.xml
QB_A02_A01.inpcrd
QB_A02_A01_input.yaml
QB_A02_A01.pdb
QB_A02_A01.prmtop
QB_A02_A01_sys.xml
run.bat
run.sh
08:10:10 (50612): Library/usr/bin/tar.exe exited; CPU time 0.000000
08:10:10 (50612): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
The system cannot find the file specified.
Could Not Find C:\ProgramData\BOINC\slots\0\Library\etc\OpenCL\vendors\temp.txt
WARNING: The script pyaml.exe is installed in 'C:\ProgramData\BOINC\slots\0\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\0\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.
Could not find platform independent libraries <prefix>
Python path configuration:
PYTHONHOME = (not set)
PYTHONPATH = 'C:\ProgramData\BOINC\slots\0\Lib\python3.11\site-packages'
program name = 'python.exe'
isolated = 0
environment = 1
user site = 1
safe_path = 0
import site = 1
is in build tree = 0
stdlib dir = 'C:\ProgramData\BOINC\slots\0\Lib'
sys._base_executable = 'C:\\ProgramData\\BOINC\\slots\\0\\python.exe'
sys.base_prefix = 'C:\\ProgramData\\BOINC\\slots\\0'
sys.base_exec_prefix = 'C:\\ProgramData\\BOINC\\slots\\0'
sys.platlibdir = 'DLLs'
sys.executable = 'C:\\ProgramData\\BOINC\\slots\\0\\python.exe'
sys.prefix = 'C:\\ProgramData\\BOINC\\slots\\0'
sys.exec_prefix = 'C:\\ProgramData\\BOINC\\slots\\0'
sys.path = [
'C:\\ProgramData\\BOINC\\slots\\0\\Lib\\python3.11\\site-packages',
'C:\\ProgramData\\BOINC\\slots\\0\\python311.zip',
'C:\\ProgramData\\BOINC\\slots\\0\\DLLs',
'C:\\ProgramData\\BOINC\\slots\\0\\Lib',
'C:\\ProgramData\\BOINC\\slots\\0',
]
Fatal Python error: init_fs_encoding: failed to get the Python codec of the filesystem encoding
Python runtime state: core initialized
ModuleNotFoundError: No module named 'encodings'
Current thread 0x00006b78 (most recent call first):
<no Python frame>
08:11:04 (50612): C:/Windows/system32/cmd.exe exited; CPU time 6.468750
08:11:04 (50612): app exit status: 0x16
08:11:04 (50612): called boinc_finish(195)
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: 1329553 bytes.
Dumping objects ->
{3835593} normal block at 0x0000019236BA0280, 48 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835582} normal block at 0x0000019236BA0210, 48 bytes long.
Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835571} normal block at 0x0000019236B9FE90, 48 bytes long.
Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61
{3835560} normal block at 0x0000019236B9FE20, 48 bytes long.
Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835549} normal block at 0x0000019236BA01A0, 48 bytes long.
Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61
{3835518} normal block at 0x0000019238887800, 64 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835507} normal block at 0x000001923889E470, 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) : {3835504} normal block at 0x0000019236BA4420, 8 bytes long.
Data: < ÷6’ > 00 00 F7 36 92 01 00 00
{3834703} normal block at 0x000001923889DCE0, 102 bytes long.
Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65
{3833941} normal block at 0x0000019236BA3A20, 8 bytes long.
Data: < 3‘8’ > 80 33 91 38 92 01 00 00
..\zip\boinc_zip.cpp(122) : {302} normal block at 0x0000019236B9B650, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x0000019236B21820, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
{286} normal block at 0x0000019236BA4060, 16 bytes long.
Data: <h5º6’ > 68 35 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{285} normal block at 0x0000019236BA3C50, 16 bytes long.
Data: <@5º6’ > 40 35 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{284} normal block at 0x0000019236B9C580, 32 bytes long.
Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D
{283} normal block at 0x0000019236BA4240, 16 bytes long.
Data: < 5º6’ > 18 35 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x0000019236BA41F0, 16 bytes long.
Data: <ð4º6’ > F0 34 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x0000019236B9EB10, 16 bytes long.
Data: <È4º6’ > C8 34 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x0000019236B9F790, 16 bytes long.
Data: < 4º6’ > A0 34 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x0000019236BA00C0, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{278} normal block at 0x0000019236B9EAC0, 16 bytes long.
Data: <(1º6’ > 28 31 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x0000019236B9C520, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{276} normal block at 0x0000019236B9F740, 16 bytes long.
Data: < 1º6’ > 00 31 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{274} normal block at 0x0000019236B9F650, 16 bytes long.
Data: <Ø0º6’ > D8 30 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{273} normal block at 0x0000019236B9EC00, 16 bytes long.
Data: <°0º6’ > B0 30 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{272} normal block at 0x0000019236B9F010, 16 bytes long.
Data: < 0º6’ > 88 30 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{271} normal block at 0x0000019236B9F830, 16 bytes long.
Data: <`0º6’ > 60 30 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{270} normal block at 0x0000019236B9F0B0, 16 bytes long.
Data: <80º6’ > 38 30 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{269} normal block at 0x0000019236B9C9A0, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{268} normal block at 0x0000019236B9F560, 16 bytes long.
Data: < 0º6’ > 10 30 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x0000019236BA3010, 320 bytes long.
Data: <`õ¹6’  É¹6’ > 60 F5 B9 36 92 01 00 00 A0 C9 B9 36 92 01 00 00
{266} normal block at 0x0000019236B9F060, 16 bytes long.
Data: < 4º6’ > 80 34 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{265} normal block at 0x0000019236B9F470, 16 bytes long.
Data: <X4º6’ > 58 34 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{264} normal block at 0x0000019236B9C160, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{263} normal block at 0x0000019236B9F510, 16 bytes long.
Data: <04º6’ > 30 34 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{262} normal block at 0x0000019236B9C460, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{261} normal block at 0x0000019236B9F2E0, 16 bytes long.
Data: <x3º6’ > 78 33 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{260} normal block at 0x0000019236B9E9D0, 16 bytes long.
Data: <P3º6’ > 50 33 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{259} normal block at 0x0000019236B9F1F0, 16 bytes long.
Data: <(3º6’ > 28 33 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{258} normal block at 0x0000019236B9F240, 16 bytes long.
Data: < 3º6’ > 00 33 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{257} normal block at 0x0000019236B9E980, 16 bytes long.
Data: <Ø2º6’ > D8 32 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{256} normal block at 0x0000019236B9F1A0, 16 bytes long.
Data: <°2º6’ > B0 32 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{254} normal block at 0x0000019236B9F290, 16 bytes long.
Data: <@ º6’ > 40 04 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{253} normal block at 0x0000019236BA0440, 40 bytes long.
Data: < ò¹6’ x 8’ > 90 F2 B9 36 92 01 00 00 00 78 88 38 92 01 00 00
{252} normal block at 0x0000019236B9F150, 16 bytes long.
Data: < 2º6’ > 90 32 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{251} normal block at 0x0000019236B9EE80, 16 bytes long.
Data: <h2º6’ > 68 32 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{250} normal block at 0x0000019236B9C400, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{249} normal block at 0x0000019236B9F4C0, 16 bytes long.
Data: <@2º6’ > 40 32 BA 36 92 01 00 00 00 00 00 00 00 00 00 00
{248} normal block at 0x0000019236BA3240, 992 bytes long.
Data: <Àô¹6’ Ĺ6’ > C0 F4 B9 36 92 01 00 00 00 C4 B9 36 92 01 00 00
{84} normal block at 0x0000019236B9C040, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{83} normal block at 0x0000019236B9ECF0, 16 bytes long.
Data: <0½±6’ > 30 BD B1 36 92 01 00 00 00 00 00 00 00 00 00 00
{82} normal block at 0x0000019236B1BD30, 40 bytes long.
Data: <ðì¹6’ @À¹6’ > F0 EC B9 36 92 01 00 00 40 C0 B9 36 92 01 00 00
{61} normal block at 0x0000019236B9F6A0, 16 bytes long.
Data: < ê\×÷ > 80 EA 5C D7 F7 7F 00 00 00 00 00 00 00 00 00 00
{60} normal block at 0x0000019236B9EDE0, 16 bytes long.
Data: <@é\×÷ > 40 E9 5C D7 F7 7F 00 00 00 00 00 00 00 00 00 00
{59} normal block at 0x0000019236B9F330, 16 bytes long.
Data: <øWY×÷ > F8 57 59 D7 F7 7F 00 00 00 00 00 00 00 00 00 00
{58} normal block at 0x0000019236B9F380, 16 bytes long.
Data: <ØWY×÷ > D8 57 59 D7 F7 7F 00 00 00 00 00 00 00 00 00 00
{57} normal block at 0x0000019236B9EA70, 16 bytes long.
Data: <P Y×÷ > 50 04 59 D7 F7 7F 00 00 00 00 00 00 00 00 00 00
{56} normal block at 0x0000019236B9EF20, 16 bytes long.
Data: <0 Y×÷ > 30 04 59 D7 F7 7F 00 00 00 00 00 00 00 00 00 00
{55} normal block at 0x0000019236B9F6F0, 16 bytes long.
Data: <à Y×÷ > E0 02 59 D7 F7 7F 00 00 00 00 00 00 00 00 00 00
{54} normal block at 0x0000019236B62740, 16 bytes long.
Data: < Y×÷ > 10 04 59 D7 F7 7F 00 00 00 00 00 00 00 00 00 00
{53} normal block at 0x0000019236B635F0, 16 bytes long.
Data: <p Y×÷ > 70 04 59 D7 F7 7F 00 00 00 00 00 00 00 00 00 00
{52} normal block at 0x0000019236B635A0, 16 bytes long.
Data: < ÀW×÷ > 18 C0 57 D7 F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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