Task 38581745

Name HIF2A_A41_A03_r0_3-QUICO_ATM_GAFF2_LOMAP_HIF2A-1-5-RND6757_0
Workunit 31546180
Created 12 Dec 2025, 14:14:57 UTC
Sent 12 Dec 2025, 14:15:02 UTC
Report deadline 17 Dec 2025, 14:15:02 UTC
Received 12 Dec 2025, 15:41:17 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 609638
Run time 39 min 3 sec
CPU time 5 sec
Validate state Invalid
Credit 0.00
Device peak FLOPS 5,116.25 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 52.17 MB
Peak swap size 38.32 MB
Peak disk usage 2.81 GB

Stderr output

<core_client_version>8.2.4</core_client_version>
<![CDATA[
<message>
操作系统无法运行 (null)。
 (0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
23:01:09 (22336): wrapper (7.9.26016): starting
23:01:09 (22336): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A41_A03_0.pdb
QB_A41_A03_0.xml
QB_A41_A03_equil.pdb
QB_A41_A03.inpcrd
QB_A41_A03_input.yaml
QB_A41_A03_mdlambda.pdb
QB_A41_A03_min.pdb
QB_A41_A03_npt.pdb
QB_A41_A03.pdb
QB_A41_A03.prmtop
QB_A41_A03_sys.xml
QB_A41_A03_therm.pdb
run.bat
run.sh
23:01:11 (22336): Library/usr/bin/tar.exe exited; CPU time 0.000000
23:01:11 (22336): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
  WARNING: The script pyaml.exe is installed in 'E:\ProgramData\BOINC\slots\8\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.
ERROR: Exception:
Traceback (most recent call last):
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_vendor\urllib3\response.py", line 438, in _error_catcher
    yield
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_vendor\urllib3\response.py", line 561, in read
    data = self._fp_read(amt) if not fp_closed else b""
           ^^^^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_vendor\urllib3\response.py", line 527, in _fp_read
    return self._fp.read(amt) if amt is not None else self._fp.read()
           ^^^^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_vendor\cachecontrol\filewrapper.py", line 98, in read
    data: bytes = self.__fp.read(amt)
                  ^^^^^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\http\client.py", line 473, in read
    s = self.fp.read(amt)
        ^^^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\socket.py", line 718, in readinto
    return self._sock.recv_into(b)
           ^^^^^^^^^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\ssl.py", line 1314, in recv_into
    return self.read(nbytes, buffer)
           ^^^^^^^^^^^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\ssl.py", line 1166, in read
    return self._sslobj.read(len, buffer)
           ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
TimeoutError: The read operation timed out

During handling of the above exception, another exception occurred:

Traceback (most recent call last):
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\cli\base_command.py", line 105, in _run_wrapper
    status = _inner_run()
             ^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\cli\base_command.py", line 96, in _inner_run
    return self.run(options, args)
           ^^^^^^^^^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\cli\req_command.py", line 67, in wrapper
    return func(self, options, args)
           ^^^^^^^^^^^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\commands\install.py", line 379, in run
    requirement_set = resolver.resolve(
                      ^^^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\resolution\resolvelib\resolver.py", line 95, in resolve
    result = self._result = resolver.resolve(
                            ^^^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_vendor\resolvelib\resolvers.py", line 546, in resolve
    state = resolution.resolve(requirements, max_rounds=max_rounds)
            ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_vendor\resolvelib\resolvers.py", line 397, in resolve
    self._add_to_criteria(self.state.criteria, r, parent=None)
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_vendor\resolvelib\resolvers.py", line 173, in _add_to_criteria
    if not criterion.candidates:
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_vendor\resolvelib\structs.py", line 156, in __bool__
    return bool(self._sequence)
           ^^^^^^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\resolution\resolvelib\found_candidates.py", line 174, in __bool__
    return any(self)
           ^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\resolution\resolvelib\found_candidates.py", line 162, in <genexpr>
    return (c for c in iterator if id(c) not in self._incompatible_ids)
           ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\resolution\resolvelib\found_candidates.py", line 53, in _iter_built
    candidate = func()
                ^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\resolution\resolvelib\factory.py", line 187, in _make_candidate_from_link
    base: Optional[BaseCandidate] = self._make_base_candidate_from_link(
                                    ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\resolution\resolvelib\factory.py", line 233, in _make_base_candidate_from_link
    self._link_candidate_cache[link] = LinkCandidate(
                                       ^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\resolution\resolvelib\candidates.py", line 304, in __init__
    super().__init__(
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\resolution\resolvelib\candidates.py", line 159, in __init__
    self.dist = self._prepare()
                ^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\resolution\resolvelib\candidates.py", line 236, in _prepare
    dist = self._prepare_distribution()
           ^^^^^^^^^^^^^^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\resolution\resolvelib\candidates.py", line 315, in _prepare_distribution
    return preparer.prepare_linked_requirement(self._ireq, parallel_builds=True)
           ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\operations\prepare.py", line 527, in prepare_linked_requirement
    return self._prepare_linked_requirement(req, parallel_builds)
           ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\operations\prepare.py", line 598, in _prepare_linked_requirement
    local_file = unpack_url(
                 ^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\operations\prepare.py", line 170, in unpack_url
    file = get_http_url(
           ^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\operations\prepare.py", line 111, in get_http_url
    from_path, content_type = download(link, temp_dir.path)
                              ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\network\download.py", line 148, in __call__
    for chunk in chunks:
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\cli\progress_bars.py", line 55, in _rich_progress_bar
    for chunk in iterable:
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_internal\network\utils.py", line 65, in response_chunks
    for chunk in response.raw.stream(
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_vendor\urllib3\response.py", line 622, in stream
    data = self.read(amt=amt, decode_content=decode_content)
           ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_vendor\urllib3\response.py", line 560, in read
    with self._error_catcher():
  File "E:\ProgramData\BOINC\slots\8\Lib\contextlib.py", line 158, in __exit__
    self.gen.throw(typ, value, traceback)
  File "E:\ProgramData\BOINC\slots\8\Lib\site-packages\pip\_vendor\urllib3\response.py", line 443, in _error_catcher
    raise ReadTimeoutError(self._pool, None, "Read timed out.")
pip._vendor.urllib3.exceptions.ReadTimeoutError: HTTPSConnectionPool(host='files.pythonhosted.org', port=443): Read timed out.
python.exe: can't open file 'E:\\ProgramData\\BOINC\\slots\\8\\Scripts\\rbfe_production.exe': [Errno 2] No such file or directory
23:39:55 (22336): C:/Windows/system32/cmd.exe exited; CPU time 5.250000
23:39:55 (22336): app exit status: 0x16
23:39:55 (22336): called boinc_finish(195)
0 bytes in 0 Free Blocks.
256 bytes in 6 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: 26379357 bytes.
Dumping objects ->
{3835195} normal block at 0x0000019126205F90, 48 bytes long.
 Data: <PATH=E:\ProgramD> 50 41 54 48 3D 45 3A 5C 50 72 6F 67 72 61 6D 44 
{3835184} normal block at 0x0000019126205E40, 48 bytes long.
 Data: <HOME=E:\ProgramD> 48 4F 4D 45 3D 45 3A 5C 50 72 6F 67 72 61 6D 44 
{3835173} normal block at 0x0000019126206850, 48 bytes long.
 Data: <TMP=E:\ProgramDa> 54 4D 50 3D 45 3A 5C 50 72 6F 67 72 61 6D 44 61 
{3835162} normal block at 0x0000019126206930, 48 bytes long.
 Data: <TEMP=E:\ProgramD> 54 45 4D 50 3D 45 3A 5C 50 72 6F 67 72 61 6D 44 
{3835151} normal block at 0x00000191262062A0, 48 bytes long.
 Data: <TMPDIR=E:\Progra> 54 4D 50 44 49 52 3D 45 3A 5C 50 72 6F 67 72 61 
{3835120} normal block at 0x0000019127C7C750, 64 bytes long.
 Data: <PATH=E:\ProgramD> 50 41 54 48 3D 45 3A 5C 50 72 6F 67 72 61 6D 44 
..\api\boinc_api.cpp(309) : {3835107} normal block at 0x00000191261E39A0, 8 bytes long.
 Data: <   &    > 00 00 1B 26 91 01 00 00 
{3833944} normal block at 0x00000191261E3860, 8 bytes long.
 Data: <  ;&    > 00 EA 3B 26 91 01 00 00 
..\zip\boinc_zip.cpp(122) : {301} normal block at 0x00000191261E1000, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{286} normal block at 0x00000191261E1F40, 80 bytes long.
 Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C 
{285} normal block at 0x00000191261E3270, 16 bytes long.
 Data: <X) &            > 58 29 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{284} normal block at 0x00000191261DEFC0, 16 bytes long.
 Data: <0) &            > 30 29 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{283} normal block at 0x00000191261DD340, 32 bytes long.
 Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D 
{282} normal block at 0x00000191261D49E0, 16 bytes long.
 Data: < ) &            > 08 29 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{281} normal block at 0x00000191261D4C60, 16 bytes long.
 Data: < ( &            > E0 28 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{280} normal block at 0x00000191261D4990, 16 bytes long.
 Data: < ( &            > B8 28 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{279} normal block at 0x00000191261D4940, 16 bytes long.
 Data: < ( &            > 90 28 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{278} normal block at 0x00000191261DBD30, 48 bytes long.
 Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F 
{277} normal block at 0x00000191261D48F0, 16 bytes long.
 Data: <   &            > D8 1E 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{276} normal block at 0x00000191261DD100, 32 bytes long.
 Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69 
{275} normal block at 0x00000191261D48A0, 16 bytes long.
 Data: <   &            > B0 1E 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{273} normal block at 0x00000191261D47B0, 16 bytes long.
 Data: <   &            > 88 1E 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{272} normal block at 0x00000191261D4C10, 16 bytes long.
 Data: <`  &            > 60 1E 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{271} normal block at 0x00000191261D46C0, 16 bytes long.
 Data: <8  &            > 38 1E 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x00000191261D4A30, 16 bytes long.
 Data: <   &            > 10 1E 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{269} normal block at 0x00000191261D4850, 16 bytes long.
 Data: <   &            > E8 1D 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x00000191261DD5E0, 32 bytes long.
 Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55 
{267} normal block at 0x00000191261D4670, 16 bytes long.
 Data: <   &            > C0 1D 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{266} normal block at 0x00000191261E1DC0, 320 bytes long.
 Data: <pF &       &    > 70 46 1D 26 91 01 00 00 E0 D5 1D 26 91 01 00 00 
{265} normal block at 0x00000191261D4620, 16 bytes long.
 Data: <p( &            > 70 28 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{264} normal block at 0x00000191261D45D0, 16 bytes long.
 Data: <H( &            > 48 28 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{263} normal block at 0x00000191261DDC40, 32 bytes long.
 Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65 
{262} normal block at 0x00000191261D4490, 16 bytes long.
 Data: < ( &            > 20 28 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{261} normal block at 0x00000191261DD580, 32 bytes long.
 Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62 
{260} normal block at 0x00000191261D4710, 16 bytes long.
 Data: <h' &            > 68 27 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{259} normal block at 0x00000191261D43F0, 16 bytes long.
 Data: <@' &            > 40 27 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{258} normal block at 0x00000191261D43A0, 16 bytes long.
 Data: < ' &            > 18 27 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{257} normal block at 0x00000191261D4080, 16 bytes long.
 Data: < & &            > F0 26 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{256} normal block at 0x00000191261DF4C0, 16 bytes long.
 Data: < & &            > C8 26 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{255} normal block at 0x00000191261DF420, 16 bytes long.
 Data: < & &            > A0 26 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{253} normal block at 0x00000191261DF3D0, 16 bytes long.
 Data: <   &            > C0 BC 1D 26 91 01 00 00 00 00 00 00 00 00 00 00 
{252} normal block at 0x00000191261DBCC0, 40 bytes long.
 Data: <   &    P  '    > D0 F3 1D 26 91 01 00 00 50 C7 C7 27 91 01 00 00 
{251} normal block at 0x00000191261DF2E0, 16 bytes long.
 Data: < & &            > 80 26 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{250} normal block at 0x00000191261DF6A0, 16 bytes long.
 Data: <X& &            > 58 26 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{249} normal block at 0x00000191261DD0A0, 32 bytes long.
 Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F 
{248} normal block at 0x00000191261DF290, 16 bytes long.
 Data: <0& &            > 30 26 1E 26 91 01 00 00 00 00 00 00 00 00 00 00 
{247} normal block at 0x00000191261E2630, 992 bytes long.
 Data: <   &       &    > 90 F2 1D 26 91 01 00 00 A0 D0 1D 26 91 01 00 00 
{83} normal block at 0x00000191261DDB20, 32 bytes long.
 Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F 
{82} normal block at 0x00000191261D4350, 16 bytes long.
 Data: <P  &            > 50 BC 1D 26 91 01 00 00 00 00 00 00 00 00 00 00 
{81} normal block at 0x00000191261DBC50, 40 bytes long.
 Data: <PC &       &    > 50 43 1D 26 91 01 00 00 20 DB 1D 26 91 01 00 00 
{60} normal block at 0x00000191261D4B70, 16 bytes long.
 Data: <                > 80 EA 17 B3 F7 7F 00 00 00 00 00 00 00 00 00 00 
{59} normal block at 0x00000191261D4300, 16 bytes long.
 Data: <@               > 40 E9 17 B3 F7 7F 00 00 00 00 00 00 00 00 00 00 
{58} normal block at 0x00000191261D4CB0, 16 bytes long.
 Data: < W              > F8 57 14 B3 F7 7F 00 00 00 00 00 00 00 00 00 00 
{57} normal block at 0x00000191261D4580, 16 bytes long.
 Data: < W              > D8 57 14 B3 F7 7F 00 00 00 00 00 00 00 00 00 00 
{56} normal block at 0x00000191261D42B0, 16 bytes long.
 Data: <P               > 50 04 14 B3 F7 7F 00 00 00 00 00 00 00 00 00 00 
{55} normal block at 0x00000191261D4170, 16 bytes long.
 Data: <0               > 30 04 14 B3 F7 7F 00 00 00 00 00 00 00 00 00 00 
{54} normal block at 0x00000191261D4800, 16 bytes long.
 Data: <                > E0 02 14 B3 F7 7F 00 00 00 00 00 00 00 00 00 00 
{53} normal block at 0x00000191261D4530, 16 bytes long.
 Data: <                > 10 04 14 B3 F7 7F 00 00 00 00 00 00 00 00 00 00 
{52} normal block at 0x00000191261D4210, 16 bytes long.
 Data: <p               > 70 04 14 B3 F7 7F 00 00 00 00 00 00 00 00 00 00 
{51} normal block at 0x00000191261D4120, 16 bytes long.
 Data: <                > 18 C0 12 B3 F7 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


©2025 Universitat Pompeu Fabra