Task 38607124

Name CDK2_A06_A01_r0_1-QUICO_ATM_GAFF2_NAGL_CDK2-0-6-RND1279_1
Workunit 31560739
Created 14 Apr 2026, 8:38:43 UTC
Sent 14 Apr 2026, 8:42:08 UTC
Report deadline 19 Apr 2026, 8:42:08 UTC
Received 14 Apr 2026, 8:50:39 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 36 sec
CPU time 20 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 57.56 MB
Peak swap size 40.45 MB
Peak disk usage 4.12 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>
03:47:39 (27872): wrapper (7.9.26016): starting
03:47:39 (27872): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A06_A01_0.pdb
QB_A06_A01_0.xml
QB_A06_A01.inpcrd
QB_A06_A01_input.yaml
QB_A06_A01.pdb
QB_A06_A01.prmtop
QB_A06_A01_sys.xml
run.bat
run.sh
03:47:49 (27872): Library/usr/bin/tar.exe exited; CPU time 0.031250
03:47:49 (27872): 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 0x0000b134 (most recent call first):
  <no Python frame>
03:48:52 (27872): C:/Windows/system32/cmd.exe exited; CPU time 20.750000
03:48:52 (27872): app exit status: 0x16
03:48:52 (27872): 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: 1252039 bytes.
Dumping objects ->
{3835620} normal block at 0x000002202C2C5880, 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 0x000002202A4A4670, 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 0x000002202A4A4600, 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 0x000002202A4A40C0, 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 0x000002202A4A46E0, 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 0x000002202C2721C0, 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 0x000002202C27FC50, 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 0x000002202A49E770, 8 bytes long.
 Data: <  &#132;*    > 00 00 84 2A 20 02 00 00 
{3834725} normal block at 0x000002202C27F990, 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 0x000002202A49E720, 8 bytes long.
 Data: <&#240; 4,    > F0 11 34 2C 20 02 00 00 
..\zip\boinc_zip.cpp(122) : {313} normal block at 0x000002202A4A7860, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{298} normal block at 0x000002202A4A1D80, 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 0x000002202A4A5F50, 16 bytes long.
 Data: <HPJ*            > 48 50 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{296} normal block at 0x000002202A4A5F00, 16 bytes long.
 Data: < PJ*            > 20 50 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{295} normal block at 0x000002202A49D5D0, 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 0x000002202A4A57D0, 16 bytes long.
 Data: <&#248;OJ*            > F8 4F 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{293} normal block at 0x000002202A4A5780, 16 bytes long.
 Data: <&#208;OJ*            > D0 4F 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{292} normal block at 0x000002202A4A58C0, 16 bytes long.
 Data: <&#168;OJ*            > A8 4F 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{291} normal block at 0x000002202A4A5A50, 16 bytes long.
 Data: < OJ*            > 80 4F 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{290} normal block at 0x000002202A4A42F0, 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 0x000002202A4A5870, 16 bytes long.
 Data: <(IJ*            > 28 49 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{288} normal block at 0x000002202A49D390, 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 0x000002202A4A5AA0, 16 bytes long.
 Data: < IJ*            > 00 49 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x000002202A4A5730, 16 bytes long.
 Data: <&#216;HJ*            > D8 48 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{284} normal block at 0x000002202A4A53C0, 16 bytes long.
 Data: <&#176;HJ*            > B0 48 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{283} normal block at 0x000002202A4A5500, 16 bytes long.
 Data: < HJ*            > 88 48 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x000002202A4A5690, 16 bytes long.
 Data: <`HJ*            > 60 48 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{281} normal block at 0x000002202A4A54B0, 16 bytes long.
 Data: <8HJ*            > 38 48 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{280} normal block at 0x000002202A49D4B0, 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 0x000002202A4A56E0, 16 bytes long.
 Data: < HJ*            > 10 48 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{278} normal block at 0x000002202A4A4810, 320 bytes long.
 Data: <&#224;VJ*    &#176;&#212;I*    > E0 56 4A 2A 20 02 00 00 B0 D4 49 2A 20 02 00 00 
{277} normal block at 0x000002202A4A5A00, 16 bytes long.
 Data: <`OJ*            > 60 4F 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{276} normal block at 0x000002202A4A60E0, 16 bytes long.
 Data: <8OJ*            > 38 4F 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{275} normal block at 0x000002202A49DF30, 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 0x000002202A4A6090, 16 bytes long.
 Data: < OJ*            > 10 4F 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{273} normal block at 0x000002202A49D810, 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 0x000002202A4A5280, 16 bytes long.
 Data: <XNJ*            > 58 4E 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{271} normal block at 0x000002202A4A5370, 16 bytes long.
 Data: <0NJ*            > 30 4E 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x000002202A4A6040, 16 bytes long.
 Data: < NJ*            > 08 4E 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{269} normal block at 0x000002202A49E180, 16 bytes long.
 Data: <&#224;MJ*            > E0 4D 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x000002202A49E860, 16 bytes long.
 Data: <&#184;MJ*            > B8 4D 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{267} normal block at 0x000002202A49E630, 16 bytes long.
 Data: < MJ*            > 90 4D 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{265} normal block at 0x000002202A49E4F0, 16 bytes long.
 Data: <0AJ*            > 30 41 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{264} normal block at 0x000002202A4A4130, 40 bytes long.
 Data: <&#240;&#228;I*    &#192;!',    > F0 E4 49 2A 20 02 00 00 C0 21 27 2C 20 02 00 00 
{263} normal block at 0x000002202A49E0E0, 16 bytes long.
 Data: <pMJ*            > 70 4D 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{262} normal block at 0x000002202A49EF40, 16 bytes long.
 Data: <HMJ*            > 48 4D 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{261} normal block at 0x000002202A49D0F0, 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 0x000002202A49E400, 16 bytes long.
 Data: < MJ*            > 20 4D 4A 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{259} normal block at 0x000002202A4A4D20, 992 bytes long.
 Data: < &#228;I*    &#240;&#208;I*    > 00 E4 49 2A 20 02 00 00 F0 D0 49 2A 20 02 00 00 
{95} normal block at 0x000002202A49DDB0, 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 0x000002202A49E5E0, 16 bytes long.
 Data: <0&#225;A*            > 30 E1 41 2A 20 02 00 00 00 00 00 00 00 00 00 00 
{93} normal block at 0x000002202A41E130, 40 bytes long.
 Data: <&#224;&#229;I*    &#176;&#221;I*    > E0 E5 49 2A 20 02 00 00 B0 DD 49 2A 20 02 00 00 
{72} normal block at 0x000002202A49EA90, 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 0x000002202A49E590, 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 0x000002202A49EE50, 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 0x000002202A49E450, 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 0x000002202A49EB80, 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 0x000002202A49E090, 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 0x000002202A49EA40, 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 0x000002202A49ED60, 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 0x000002202A49EE00, 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 0x000002202A49E270, 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>
]]>


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