Task 38607349

Name CDK2_A09_A10_r0_1-QUICO_ATM_GAFF2_NAGL_CDK2-0-6-RND5532_1
Workunit 31560779
Created 14 Apr 2026, 9:28:30 UTC
Sent 14 Apr 2026, 9:28:32 UTC
Report deadline 19 Apr 2026, 9:28:32 UTC
Received 14 Apr 2026, 9:32:30 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 641073
Run time 2 min 30 sec
CPU time 15 sec
Validate state Invalid
Credit 0.00
Device peak FLOPS 29,155.48 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 55.50 MB
Peak swap size 39.84 MB
Peak disk usage 1.42 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>
04:30:01 (34164): wrapper (7.9.26016): starting
04:30:01 (34164): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A09_A10_0.pdb
QB_A09_A10_0.xml
QB_A09_A10.inpcrd
QB_A09_A10_input.yaml
QB_A09_A10.pdb
QB_A09_A10.prmtop
QB_A09_A10_sys.xml
run.bat
run.sh
04:30:08 (34164): Library/usr/bin/tar.exe exited; CPU time 0.000000
04:30:08 (34164): 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\3\Library\etc\OpenCL\vendors\temp.txt
  WARNING: The script pyaml.exe is installed in 'C:\ProgramData\BOINC\slots\3\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\3\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\3\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\3\Lib'
  sys._base_executable = 'C:\\ProgramData\\BOINC\\slots\\3\\python.exe'
  sys.base_prefix = 'C:\\ProgramData\\BOINC\\slots\\3'
  sys.base_exec_prefix = 'C:\\ProgramData\\BOINC\\slots\\3'
  sys.platlibdir = 'DLLs'
  sys.executable = 'C:\\ProgramData\\BOINC\\slots\\3\\python.exe'
  sys.prefix = 'C:\\ProgramData\\BOINC\\slots\\3'
  sys.exec_prefix = 'C:\\ProgramData\\BOINC\\slots\\3'
  sys.path = [
    'C:\\ProgramData\\BOINC\\slots\\3\\Lib\\python3.11\\site-packages',
    'C:\\ProgramData\\BOINC\\slots\\3\\python311.zip',
    'C:\\ProgramData\\BOINC\\slots\\3\\DLLs',
    'C:\\ProgramData\\BOINC\\slots\\3\\Lib',
    'C:\\ProgramData\\BOINC\\slots\\3',
  ]
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 0x00008ad0 (most recent call first):
  <no Python frame>
04:31:08 (34164): C:/Windows/system32/cmd.exe exited; CPU time 15.078125
04:31:08 (34164): app exit status: 0x16
04:31:08 (34164): 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: 1111779 bytes.
Dumping objects ->
{3835620} normal block at 0x000002AD3CAA6AB0, 48 bytes long.
 Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835609} normal block at 0x000002AD3AC323F0, 48 bytes long.
 Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835598} normal block at 0x000002AD3AC32AF0, 48 bytes long.
 Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61 
{3835587} normal block at 0x000002AD3AC32930, 48 bytes long.
 Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835576} normal block at 0x000002AD3AC328C0, 48 bytes long.
 Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61 
{3835545} normal block at 0x000002AD3CA482B0, 64 bytes long.
 Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835534} normal block at 0x000002AD3CA5F620, 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) : {3835531} normal block at 0x000002AD3AC2EC50, 8 bytes long.
 Data: <  t<&#173;   > 00 00 74 3C AD 02 00 00 
{3834725} normal block at 0x000002AD3CA60070, 102 bytes long.
 Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65 
{3833963} normal block at 0x000002AD3AC2E9D0, 8 bytes long.
 Data: <p&#215;&#186;:&#173;   > 70 D7 BA 3A AD 02 00 00 
..\zip\boinc_zip.cpp(122) : {313} normal block at 0x000002AD3AC34FA0, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{298} normal block at 0x000002AD3ABB2200, 80 bytes long.
 Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C 
{297} normal block at 0x000002AD3AC33950, 16 bytes long.
 Data: < 5&#195;:&#173;           > 88 35 C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{296} normal block at 0x000002AD3AC33EF0, 16 bytes long.
 Data: <`5&#195;:&#173;           > 60 35 C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{295} normal block at 0x000002AD3AC2E0C0, 32 bytes long.
 Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D 
{294} normal block at 0x000002AD3AC33CC0, 16 bytes long.
 Data: <85&#195;:&#173;           > 38 35 C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{293} normal block at 0x000002AD3AC33DB0, 16 bytes long.
 Data: < 5&#195;:&#173;           > 10 35 C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{292} normal block at 0x000002AD3AC33AE0, 16 bytes long.
 Data: <&#232;4&#195;:&#173;           > E8 34 C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{291} normal block at 0x000002AD3AC34440, 16 bytes long.
 Data: <&#192;4&#195;:&#173;           > C0 34 C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{290} normal block at 0x000002AD3AC325B0, 48 bytes long.
 Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F 
{289} normal block at 0x000002AD3AC343A0, 16 bytes long.
 Data: <&#200;,&#195;:&#173;           > C8 2C C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{288} normal block at 0x000002AD3AC2D6A0, 32 bytes long.
 Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69 
{287} normal block at 0x000002AD3AC345D0, 16 bytes long.
 Data: <&#160;,&#195;:&#173;           > A0 2C C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x000002AD3AC33900, 16 bytes long.
 Data: <x,&#195;:&#173;           > 78 2C C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{284} normal block at 0x000002AD3AC33810, 16 bytes long.
 Data: <P,&#195;:&#173;           > 50 2C C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{283} normal block at 0x000002AD3AC338B0, 16 bytes long.
 Data: <(,&#195;:&#173;           > 28 2C C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x000002AD3AC337C0, 16 bytes long.
 Data: < ,&#195;:&#173;           > 00 2C C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{281} normal block at 0x000002AD3AC33FE0, 16 bytes long.
 Data: <&#216;+&#195;:&#173;           > D8 2B C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{280} normal block at 0x000002AD3AC2DD60, 32 bytes long.
 Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55 
{279} normal block at 0x000002AD3AC34300, 16 bytes long.
 Data: <&#176;+&#195;:&#173;           > B0 2B C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{278} normal block at 0x000002AD3AC32BB0, 320 bytes long.
 Data: < C&#195;:&#173;   `&#221;&#194;:&#173;   > 00 43 C3 3A AD 02 00 00 60 DD C2 3A AD 02 00 00 
{277} normal block at 0x000002AD3AC33A90, 16 bytes long.
 Data: <&#160;4&#195;:&#173;           > A0 34 C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{276} normal block at 0x000002AD3AC340D0, 16 bytes long.
 Data: <x4&#195;:&#173;           > 78 34 C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{275} normal block at 0x000002AD3AC2D520, 32 bytes long.
 Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65 
{274} normal block at 0x000002AD3AC33860, 16 bytes long.
 Data: <P4&#195;:&#173;           > 50 34 C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{273} normal block at 0x000002AD3AC2DBE0, 32 bytes long.
 Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62 
{272} normal block at 0x000002AD3AC34120, 16 bytes long.
 Data: < 3&#195;:&#173;           > 98 33 C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{271} normal block at 0x000002AD3AC34580, 16 bytes long.
 Data: <p3&#195;:&#173;           > 70 33 C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x000002AD3AC34080, 16 bytes long.
 Data: <H3&#195;:&#173;           > 48 33 C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{269} normal block at 0x000002AD3AC2E700, 16 bytes long.
 Data: < 3&#195;:&#173;           > 20 33 C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x000002AD3AC2E4D0, 16 bytes long.
 Data: <&#248;2&#195;:&#173;           > F8 32 C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{267} normal block at 0x000002AD3AC2F240, 16 bytes long.
 Data: <&#208;2&#195;:&#173;           > D0 32 C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{265} normal block at 0x000002AD3AC2F1A0, 16 bytes long.
 Data: <@%&#195;:&#173;           > 40 25 C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{264} normal block at 0x000002AD3AC32540, 40 bytes long.
 Data: <&#160;&#241;&#194;:&#173;   &#176;&#130;&#164;<&#173;   > A0 F1 C2 3A AD 02 00 00 B0 82 A4 3C AD 02 00 00 
{263} normal block at 0x000002AD3AC2F150, 16 bytes long.
 Data: <&#176;2&#195;:&#173;           > B0 32 C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{262} normal block at 0x000002AD3AC2ED40, 16 bytes long.
 Data: < 2&#195;:&#173;           > 88 32 C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{261} normal block at 0x000002AD3AC2D4C0, 32 bytes long.
 Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F 
{260} normal block at 0x000002AD3AC2EAC0, 16 bytes long.
 Data: <`2&#195;:&#173;           > 60 32 C3 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{259} normal block at 0x000002AD3AC33260, 992 bytes long.
 Data: <&#192;&#234;&#194;:&#173;   &#192;&#212;&#194;:&#173;   > C0 EA C2 3A AD 02 00 00 C0 D4 C2 3A AD 02 00 00 
{95} normal block at 0x000002AD3AC2DCA0, 32 bytes long.
 Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F 
{94} normal block at 0x000002AD3AC2E7F0, 16 bytes long.
 Data: < &#193;&#186;:&#173;           > 80 C1 BA 3A AD 02 00 00 00 00 00 00 00 00 00 00 
{93} normal block at 0x000002AD3ABAC180, 40 bytes long.
 Data: <&#240;&#231;&#194;:&#173;   &#160;&#220;&#194;:&#173;   > F0 E7 C2 3A AD 02 00 00 A0 DC C2 3A AD 02 00 00 
{72} normal block at 0x000002AD3AC2EFC0, 16 bytes long.
 Data: < &#234;&#234;&#158;&#246;           > 80 EA EA 9E F6 7F 00 00 00 00 00 00 00 00 00 00 
{71} normal block at 0x000002AD3AC2EE80, 16 bytes long.
 Data: <@&#233;&#234;&#158;&#246;           > 40 E9 EA 9E F6 7F 00 00 00 00 00 00 00 00 00 00 
{70} normal block at 0x000002AD3AC2EF20, 16 bytes long.
 Data: <&#248;W&#231;&#158;&#246;           > F8 57 E7 9E F6 7F 00 00 00 00 00 00 00 00 00 00 
{69} normal block at 0x000002AD3AC2F2E0, 16 bytes long.
 Data: <&#216;W&#231;&#158;&#246;           > D8 57 E7 9E F6 7F 00 00 00 00 00 00 00 00 00 00 
{68} normal block at 0x000002AD3AC2F290, 16 bytes long.
 Data: <P &#231;&#158;&#246;           > 50 04 E7 9E F6 7F 00 00 00 00 00 00 00 00 00 00 
{67} normal block at 0x000002AD3AC2EBB0, 16 bytes long.
 Data: <0 &#231;&#158;&#246;           > 30 04 E7 9E F6 7F 00 00 00 00 00 00 00 00 00 00 
{66} normal block at 0x000002AD3AC2E8E0, 16 bytes long.
 Data: <&#224; &#231;&#158;&#246;           > E0 02 E7 9E F6 7F 00 00 00 00 00 00 00 00 00 00 
{65} normal block at 0x000002AD3AC2EA20, 16 bytes long.
 Data: <  &#231;&#158;&#246;           > 10 04 E7 9E F6 7F 00 00 00 00 00 00 00 00 00 00 
{64} normal block at 0x000002AD3AC2F420, 16 bytes long.
 Data: <p &#231;&#158;&#246;           > 70 04 E7 9E F6 7F 00 00 00 00 00 00 00 00 00 00 
{63} normal block at 0x000002AD3AC2ED90, 16 bytes long.
 Data: < &#192;&#229;&#158;&#246;           > 18 C0 E5 9E F6 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


©2026 Universitat Pompeu Fabra