Task 38599517
| Name | BACE_A12_A25_r0_1-QUICO_ATM_GAFF2_NAGL_BACE-1-6-RND6026_1 |
| Workunit | 31554418 |
| Created | 8 Apr 2026, 18:36:36 UTC |
| Sent | 8 Apr 2026, 18:36:43 UTC |
| Report deadline | 13 Apr 2026, 18:36:43 UTC |
| Received | 8 Apr 2026, 18:40:23 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 195 (0x000000C3) EXIT_CHILD_FAILED |
| Computer ID | 642172 |
| Run time | 1 min 39 sec |
| CPU time | 10 sec |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 8,885.46 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 54.14 MB |
| Peak swap size | 37.42 MB |
| Peak disk usage | 4.15 GB |
Stderr output
<core_client_version>8.2.8</core_client_version>
<![CDATA[
<message>
The operating system cannot run (null).
(0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
13:38:06 (21264): wrapper (7.9.26016): starting
13:38:06 (21264): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A12_A25_0.pdb
QB_A12_A25_0.xml
QB_A12_A25.inpcrd
QB_A12_A25_input.yaml
QB_A12_A25.pdb
QB_A12_A25.prmtop
QB_A12_A25_sys.xml
run.bat
run.sh
13:38:08 (21264): Library/usr/bin/tar.exe exited; CPU time 0.000000
13:38:08 (21264): 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\1\Library\etc\OpenCL\vendors\temp.txt
WARNING: The script pyaml.exe is installed in 'C:\ProgramData\BOINC\slots\1\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\1\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\1\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\1\Lib'
sys._base_executable = 'C:\\ProgramData\\BOINC\\slots\\1\\python.exe'
sys.base_prefix = 'C:\\ProgramData\\BOINC\\slots\\1'
sys.base_exec_prefix = 'C:\\ProgramData\\BOINC\\slots\\1'
sys.platlibdir = 'DLLs'
sys.executable = 'C:\\ProgramData\\BOINC\\slots\\1\\python.exe'
sys.prefix = 'C:\\ProgramData\\BOINC\\slots\\1'
sys.exec_prefix = 'C:\\ProgramData\\BOINC\\slots\\1'
sys.path = [
'C:\\ProgramData\\BOINC\\slots\\1\\Lib\\python3.11\\site-packages',
'C:\\ProgramData\\BOINC\\slots\\1\\python311.zip',
'C:\\ProgramData\\BOINC\\slots\\1\\DLLs',
'C:\\ProgramData\\BOINC\\slots\\1\\Lib',
'C:\\ProgramData\\BOINC\\slots\\1',
]
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 0x000063f0 (most recent call first):
<no Python frame>
13:38:41 (21264): C:/Windows/system32/cmd.exe exited; CPU time 10.500000
13:38:41 (21264): app exit status: 0x16
13:38:41 (21264): 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: 793613 bytes.
Dumping objects ->
{3835553} normal block at 0x000001839CD54B00, 48 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835542} normal block at 0x000001839CD54860, 48 bytes long.
Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835531} normal block at 0x000001839CD54A90, 48 bytes long.
Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61
{3835520} normal block at 0x000001839AFE5680, 48 bytes long.
Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835509} normal block at 0x000001839AFE55A0, 48 bytes long.
Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61
{3835478} normal block at 0x000001839CDAA390, 64 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835467} normal block at 0x000001839CDC2270, 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) : {3835464} normal block at 0x000001839AFE6920, 8 bytes long.
Data: < ®œƒ > 00 00 AE 9C 83 01 00 00
{3834689} normal block at 0x000001839CDC2320, 102 bytes long.
Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65
{3833957} normal block at 0x000001839AFE6510, 8 bytes long.
Data: <@{㜃 > 40 7B E3 9C 83 01 00 00
..\zip\boinc_zip.cpp(122) : {310} normal block at 0x000001839AFE9280, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{295} normal block at 0x000001839AF62110, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
{294} normal block at 0x000001839AFE73C0, 16 bytes long.
Data: <(cþšƒ > 28 63 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{293} normal block at 0x000001839AFE7140, 16 bytes long.
Data: < cþšƒ > 00 63 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x000001839AFE0770, 32 bytes long.
Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D
{291} normal block at 0x000001839AFE6EC0, 16 bytes long.
Data: <Øbþšƒ > D8 62 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{290} normal block at 0x000001839AFE70F0, 16 bytes long.
Data: <°bþšƒ > B0 62 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x000001839AFE6970, 16 bytes long.
Data: < bþšƒ > 88 62 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{288} normal block at 0x000001839AFE16C0, 16 bytes long.
Data: <`bþšƒ > 60 62 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x000001839AFE5220, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{286} normal block at 0x000001839AFE1670, 16 bytes long.
Data: <8]þšƒ > 38 5D FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{285} normal block at 0x000001839AFE08F0, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{284} normal block at 0x000001839AFE2430, 16 bytes long.
Data: < ]þšƒ > 10 5D FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x000001839AFE1620, 16 bytes long.
Data: <è\þšƒ > E8 5C FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x000001839AFE2390, 16 bytes long.
Data: <À\þšƒ > C0 5C FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x000001839AFE2160, 16 bytes long.
Data: < \þšƒ > 98 5C FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x000001839AFE2340, 16 bytes long.
Data: <p\þšƒ > 70 5C FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{278} normal block at 0x000001839AFE22A0, 16 bytes long.
Data: <H\þšƒ > 48 5C FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x000001839AFE0650, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{276} normal block at 0x000001839AFE1850, 16 bytes long.
Data: < \þšƒ > 20 5C FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x000001839AFE5C20, 320 bytes long.
Data: <P þšƒ P þšƒ > 50 18 FE 9A 83 01 00 00 50 06 FE 9A 83 01 00 00
{274} normal block at 0x000001839AFE2070, 16 bytes long.
Data: <@bþšƒ > 40 62 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{273} normal block at 0x000001839AFE1EE0, 16 bytes long.
Data: < bþšƒ > 18 62 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{272} normal block at 0x000001839AFE0290, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{271} normal block at 0x000001839AFE1C10, 16 bytes long.
Data: <ðaþšƒ > F0 61 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{270} normal block at 0x000001839AFE0E30, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{269} normal block at 0x000001839AFE1DA0, 16 bytes long.
Data: <8aþšƒ > 38 61 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{268} normal block at 0x000001839AFE1D50, 16 bytes long.
Data: < aþšƒ > 10 61 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x000001839AFE1BC0, 16 bytes long.
Data: <è`þšƒ > E8 60 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x000001839AFE1B20, 16 bytes long.
Data: <À`þšƒ > C0 60 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{265} normal block at 0x000001839AFE1A80, 16 bytes long.
Data: < `þšƒ > 98 60 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{264} normal block at 0x000001839AFE1D00, 16 bytes long.
Data: <p`þšƒ > 70 60 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{262} normal block at 0x000001839AFE1990, 16 bytes long.
Data: <@Qþšƒ > 40 51 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{261} normal block at 0x000001839AFE5140, 40 bytes long.
Data: < þšƒ £Úœƒ > 90 19 FE 9A 83 01 00 00 90 A3 DA 9C 83 01 00 00
{260} normal block at 0x000001839AFE1E90, 16 bytes long.
Data: <P`þšƒ > 50 60 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{259} normal block at 0x000001839AFE18A0, 16 bytes long.
Data: <(`þšƒ > 28 60 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{258} normal block at 0x000001839AFE06B0, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{257} normal block at 0x000001839AFE20C0, 16 bytes long.
Data: < `þšƒ > 00 60 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{256} normal block at 0x000001839AFE6000, 992 bytes long.
Data: <À þšƒ ° þšƒ > C0 20 FE 9A 83 01 00 00 B0 06 FE 9A 83 01 00 00
{92} normal block at 0x000001839AFE0590, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{91} normal block at 0x000001839AFE1940, 16 bytes long.
Data: < Sþšƒ > 00 53 FE 9A 83 01 00 00 00 00 00 00 00 00 00 00
{90} normal block at 0x000001839AFE5300, 40 bytes long.
Data: <@ þšƒ þšƒ > 40 19 FE 9A 83 01 00 00 90 05 FE 9A 83 01 00 00
{69} normal block at 0x000001839AFE1800, 16 bytes long.
Data: < ê r÷ > 80 EA 1D 72 F7 7F 00 00 00 00 00 00 00 00 00 00
{68} normal block at 0x000001839AFE1580, 16 bytes long.
Data: <@é r÷ > 40 E9 1D 72 F7 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x000001839AFE1A30, 16 bytes long.
Data: <øW r÷ > F8 57 1A 72 F7 7F 00 00 00 00 00 00 00 00 00 00
{66} normal block at 0x000001839AFE14E0, 16 bytes long.
Data: <ØW r÷ > D8 57 1A 72 F7 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x000001839AFE21B0, 16 bytes long.
Data: <P r÷ > 50 04 1A 72 F7 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x000001839AFE1AD0, 16 bytes long.
Data: <0 r÷ > 30 04 1A 72 F7 7F 00 00 00 00 00 00 00 00 00 00
{63} normal block at 0x000001839AFE1F30, 16 bytes long.
Data: <à r÷ > E0 02 1A 72 F7 7F 00 00 00 00 00 00 00 00 00 00
{62} normal block at 0x000001839AFE1FD0, 16 bytes long.
Data: < r÷ > 10 04 1A 72 F7 7F 00 00 00 00 00 00 00 00 00 00
{61} normal block at 0x000001839AFA3570, 16 bytes long.
Data: <p r÷ > 70 04 1A 72 F7 7F 00 00 00 00 00 00 00 00 00 00
{60} normal block at 0x000001839AFA3430, 16 bytes long.
Data: < À r÷ > 18 C0 18 72 F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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