Task 38635721

Name p38_3_A26_A08_r0_3-QUICO_ATM_OpenFF_NAGL_p38_3-1-6-RND7199_0
Workunit 31584112
Created 28 Apr 2026, 17:39:22 UTC
Sent 28 Apr 2026, 17:39:32 UTC
Report deadline 3 May 2026, 17:39:32 UTC
Received 28 Apr 2026, 17:45:36 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 599714
Run time 3 min 54 sec
CPU time 4 sec
Validate state Invalid
Credit 0.00
Device peak FLOPS 115,554.19 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 54.50 MB
Peak swap size 38.89 MB
Peak disk usage 3.45 GB

Stderr output

<core_client_version>8.2.9</core_client_version>
<![CDATA[
<message>
System operacyjny nie mo�e uruchomi� (null).
 (0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
19:42:10 (28940): wrapper (7.9.26016): starting
19:42:10 (28940): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A26_A08_0.pdb
QB_A26_A08_0.xml
QB_A26_A08.inpcrd
QB_A26_A08_input.yaml
QB_A26_A08.pdb
QB_A26_A08.prmtop
QB_A26_A08_sys.xml
run.bat
run.sh
19:42:13 (28940): Library/usr/bin/tar.exe exited; CPU time 0.031250
19:42:13 (28940): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
ERROR: Could not install packages due to an OSError.
Consider using the `--user` option or check the permissions.
Traceback (most recent call last):
  File "C:\ProgramData\BOINC\slots\11\Lib\site-packages\pip\_internal\commands\install.py", line 379, in run
    requirement_set = resolver.resolve(
                      ^^^^^^^^^^^^^^^^^
  File "C:\ProgramData\BOINC\slots\11\Lib\site-packages\pip\_internal\resolution\resolvelib\resolver.py", line 179, in resolve
    self.factory.preparer.prepare_linked_requirements_more(reqs)
  File "C:\ProgramData\BOINC\slots\11\Lib\site-packages\pip\_internal\operations\prepare.py", line 554, in prepare_linked_requirements_more
    self._complete_partial_requirements(
  File "C:\ProgramData\BOINC\slots\11\Lib\site-packages\pip\_internal\operations\prepare.py", line 489, in _complete_partial_requirements
    self._prepare_linked_requirement(req, parallel_builds)
  File "C:\ProgramData\BOINC\slots\11\Lib\site-packages\pip\_internal\operations\prepare.py", line 615, in _prepare_linked_requirement
    local_file = File(file_path, content_type=None)
                 ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
  File "<string>", line 5, in __init__
  File "C:\ProgramData\BOINC\slots\11\Lib\site-packages\pip\_internal\operations\prepare.py", line 91, in __post_init__
    self.content_type = mimetypes.guess_type(self.path)[0]
                        ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
  File "C:\ProgramData\BOINC\slots\11\Lib\mimetypes.py", line 312, in guess_type
    init()
  File "C:\ProgramData\BOINC\slots\11\Lib\mimetypes.py", line 374, in init
    db.read_windows_registry()
  File "C:\ProgramData\BOINC\slots\11\Lib\mimetypes.py", line 259, in read_windows_registry
    _mimetypes_read_windows_registry(add_type)
PermissionError: [WinError 5] Odmowa dost&#234;pu
  Running command pip subprocess to install build dependencies
  Using pip 24.3.1 from C:\ProgramData\BOINC\slots\11\Lib\site-packages\pip (python 3.11)
  Collecting setuptools
    Obtaining dependency information for setuptools from https://files.pythonhosted.org/packages/9d/76/f789f7a86709c6b087c5a2f52f911838cad707cc613162401badc665acfe/setuptools-82.0.1-py3-none-any.whl.metadata
    Using cached setuptools-82.0.1-py3-none-any.whl.metadata (6.5 kB)
  Collecting setuptools-scm>=8
    Obtaining dependency information for setuptools-scm>=8 from https://files.pythonhosted.org/packages/5c/e1/342c4434df56aa537f6ce7647eefee521d96fbb828b08acd709865767652/setuptools_scm-10.0.5-py3-none-any.whl.metadata
    Using cached setuptools_scm-10.0.5-py3-none-any.whl.metadata (6.5 kB)
  Collecting vcs-versioning>=1.0.0.dev0 (from setuptools-scm>=8)
    Obtaining dependency information for vcs-versioning>=1.0.0.dev0 from https://files.pythonhosted.org/packages/e6/60/73603fbcdbe5e803855bcce4414f94eaeed449083bd8183e67161af78188/vcs_versioning-1.1.1-py3-none-any.whl.metadata
    Using cached vcs_versioning-1.1.1-py3-none-any.whl.metadata (1.6 kB)
  Collecting packaging>=20 (from setuptools-scm>=8)
    Obtaining dependency information for packaging>=20 from https://files.pythonhosted.org/packages/df/b2/87e62e8c3e2f4b32e5fe99e0b86d576da1312593b39f47d8ceef365e95ed/packaging-26.2-py3-none-any.whl.metadata
    Using cached packaging-26.2-py3-none-any.whl.metadata (3.5 kB)
  Using cached setuptools-82.0.1-py3-none-any.whl (1.0 MB)
  Using cached setuptools_scm-10.0.5-py3-none-any.whl (21 kB)
  Using cached packaging-26.2-py3-none-any.whl (100 kB)
  Using cached vcs_versioning-1.1.1-py3-none-any.whl (79 kB)
  ERROR: Could not install packages due to an OSError.
  Consider using the `--user` option or check the permissions.
  Traceback (most recent call last):
    File "C:\ProgramData\BOINC\slots\11\Lib\site-packages\pip\_internal\commands\install.py", line 379, in run
      requirement_set = resolver.resolve(
                        ^^^^^^^^^^^^^^^^^
    File "C:\ProgramData\BOINC\slots\11\Lib\site-packages\pip\_internal\resolution\resolvelib\resolver.py", line 179, in resolve
      self.factory.preparer.prepare_linked_requirements_more(reqs)
    File "C:\ProgramData\BOINC\slots\11\Lib\site-packages\pip\_internal\operations\prepare.py", line 554, in prepare_linked_requirements_more
      self._complete_partial_requirements(
    File "C:\ProgramData\BOINC\slots\11\Lib\site-packages\pip\_internal\operations\prepare.py", line 489, in _complete_partial_requirements
      self._prepare_linked_requirement(req, parallel_builds)
    File "C:\ProgramData\BOINC\slots\11\Lib\site-packages\pip\_internal\operations\prepare.py", line 615, in _prepare_linked_requirement
      local_file = File(file_path, content_type=None)
                   ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
    File "<string>", line 5, in __init__
    File "C:\ProgramData\BOINC\slots\11\Lib\site-packages\pip\_internal\operations\prepare.py", line 91, in __post_init__
      self.content_type = mimetypes.guess_type(self.path)[0]
                          ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
    File "C:\ProgramData\BOINC\slots\11\Lib\mimetypes.py", line 312, in guess_type
      init()
    File "C:\ProgramData\BOINC\slots\11\Lib\mimetypes.py", line 374, in init
      db.read_windows_registry()
    File "C:\ProgramData\BOINC\slots\11\Lib\mimetypes.py", line 259, in read_windows_registry
      _mimetypes_read_windows_registry(add_type)
  PermissionError: [WinError 5] Odmowa dost&#234;pu
  error: subprocess-exited-with-error
  
  pip subprocess to install build dependencies did not run successfully.
  exit code: 1
  
  See above for output.
  
  note: This error originates from a subprocess, and is likely not a problem with pip.
  full command: 'C:\ProgramData\BOINC\slots\11\python.exe' 'C:\ProgramData\BOINC\slots\11\Lib\site-packages\pip\__pip-runner__.py' install --ignore-installed --no-user --prefix 'C:\ProgramData\BOINC\slots\11\pip-build-env-x0yj21_t\overlay' --no-warn-script-location --disable-pip-version-check --target '' -v --no-binary :none: --only-binary :none: -i https://pypi.org/simple -- setuptools 'setuptools-scm>=8'
  cwd: [inherit]
error: subprocess-exited-with-error

pip subprocess to install build dependencies did not run successfully.
exit code: 1

See above for output.

note: This error originates from a subprocess, and is likely not a problem with pip.
python.exe: can't open file 'C:\\ProgramData\\BOINC\\slots\\11\\Scripts\\rbfe_production.exe': [Errno 2] No such file or directory
19:43:41 (28940): C:/Windows/system32/cmd.exe exited; CPU time 4.546875
19:43:41 (28940): app exit status: 0x16
19:43:41 (28940): called boinc_finish(195)
0 bytes in 0 Free Blocks.
536 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: 1542967 bytes.
Dumping objects ->
{3835237} normal block at 0x000001EE3AFCE350, 48 bytes long.
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{3835226} normal block at 0x000001EE39355560, 48 bytes long.
 Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835215} normal block at 0x000001EE39355A30, 48 bytes long.
 Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61 
{3835204} normal block at 0x000001EE39355800, 48 bytes long.
 Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835193} normal block at 0x000001EE39355950, 48 bytes long.
 Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61 
{3835162} normal block at 0x000001EE3B015C30, 64 bytes long.
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{3835151} normal block at 0x000001EE393ADF70, 140 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) : {3835148} normal block at 0x000001EE3934D6C0, 8 bytes long.
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{3834549} normal block at 0x000001EE393ADEA0, 140 bytes long.
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{3833957} normal block at 0x000001EE3934DA30, 8 bytes long.
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..\zip\boinc_zip.cpp(122) : {310} normal block at 0x000001EE393417F0, 260 bytes long.
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{295} normal block at 0x000001EE393426C0, 80 bytes long.
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{294} normal block at 0x000001EE39356DA0, 16 bytes long.
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{293} normal block at 0x000001EE39356D50, 16 bytes long.
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{292} normal block at 0x000001EE393504C0, 32 bytes long.
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{291} normal block at 0x000001EE39356CB0, 16 bytes long.
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{290} normal block at 0x000001EE39356C10, 16 bytes long.
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{289} normal block at 0x000001EE39356BC0, 16 bytes long.
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{288} normal block at 0x000001EE39355FE0, 16 bytes long.
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{287} normal block at 0x000001EE393559C0, 48 bytes long.
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{286} normal block at 0x000001EE39356B20, 16 bytes long.
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{285} normal block at 0x000001EE393502E0, 32 bytes long.
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{284} normal block at 0x000001EE39356AD0, 16 bytes long.
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{282} normal block at 0x000001EE393566C0, 16 bytes long.
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{281} normal block at 0x000001EE393565D0, 16 bytes long.
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{280} normal block at 0x000001EE39356030, 16 bytes long.
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{279} normal block at 0x000001EE393564E0, 16 bytes long.
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{278} normal block at 0x000001EE39356A30, 16 bytes long.
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{277} normal block at 0x000001EE39350700, 32 bytes long.
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{276} normal block at 0x000001EE393569E0, 16 bytes long.
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{275} normal block at 0x000001EE39340920, 320 bytes long.
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{274} normal block at 0x000001EE39356850, 16 bytes long.
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{273} normal block at 0x000001EE393563F0, 16 bytes long.
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{272} normal block at 0x000001EE39350220, 32 bytes long.
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{271} normal block at 0x000001EE39356990, 16 bytes long.
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{270} normal block at 0x000001EE393501C0, 32 bytes long.
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{269} normal block at 0x000001EE39356D00, 16 bytes long.
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{268} normal block at 0x000001EE393568F0, 16 bytes long.
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{267} normal block at 0x000001EE39356C60, 16 bytes long.
 Data: <&#232;o59&#238;           > E8 6F 35 39 EE 01 00 00 00 00 00 00 00 00 00 00 
{266} normal block at 0x000001EE39356080, 16 bytes long.
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{265} normal block at 0x000001EE393567B0, 16 bytes long.
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{264} normal block at 0x000001EE39356DF0, 16 bytes long.
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{262} normal block at 0x000001EE39356670, 16 bytes long.
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{261} normal block at 0x000001EE393553A0, 40 bytes long.
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{260} normal block at 0x000001EE39356760, 16 bytes long.
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{259} normal block at 0x000001EE39356A80, 16 bytes long.
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{258} normal block at 0x000001EE3934FE60, 32 bytes long.
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{257} normal block at 0x000001EE39355F90, 16 bytes long.
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{256} normal block at 0x000001EE39356F00, 992 bytes long.
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{92} normal block at 0x000001EE3934FC80, 32 bytes long.
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{91} normal block at 0x000001EE3934DDF0, 16 bytes long.
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{90} normal block at 0x000001EE3933DF10, 40 bytes long.
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{69} normal block at 0x000001EE3934D7B0, 16 bytes long.
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{68} normal block at 0x000001EE3934D8F0, 16 bytes long.
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{67} normal block at 0x000001EE3934E200, 16 bytes long.
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{66} normal block at 0x000001EE3934DF80, 16 bytes long.
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{65} normal block at 0x000001EE3934DC60, 16 bytes long.
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{64} normal block at 0x000001EE3934D670, 16 bytes long.
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{63} normal block at 0x000001EE3934D760, 16 bytes long.
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{62} normal block at 0x000001EE3934DC10, 16 bytes long.
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{61} normal block at 0x000001EE3934E070, 16 bytes long.
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{60} normal block at 0x000001EE3934E0C0, 16 bytes long.
 Data: < &#192;c &#246;           > 18 C0 63 0F F6 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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