Task 38607376

Name tnks2_A25_A24_r0_3-QUICO_ATM_GAFF2_NAGL_TNKS2-2-6-RND1907_0
Workunit 31560876
Created 14 Apr 2026, 9:59:26 UTC
Sent 14 Apr 2026, 9:59:29 UTC
Report deadline 19 Apr 2026, 9:59:29 UTC
Received 15 Apr 2026, 5:29:03 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 651099
Run time 2 min 3 sec
CPU time 1 sec
Validate state Invalid
Credit 0.00
Device peak FLOPS 29,773.77 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 49.65 MB
Peak swap size 35.65 MB
Peak disk usage 2.06 GB

Stderr output

<core_client_version>8.2.8</core_client_version>
<![CDATA[
<message>
Das Betriebssystem kann (null) nicht ausf�hren.
 (0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
23:35:21 (9696): wrapper (7.9.26016): starting
23:35:21 (9696): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A25_A24_0.pdb
QB_A25_A24_0.xml
QB_A25_A24.inpcrd
QB_A25_A24_input.yaml
QB_A25_A24.pdb
QB_A25_A24.prmtop
QB_A25_A24_sys.xml
run.bat
run.sh
23:35:22 (9696): Library/usr/bin/tar.exe exited; CPU time 0.000000
23:35:22 (9696): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
WARNING: Retrying (Retry(total=4, connect=None, read=None, redirect=None, status=None)) after connection broken by 'NewConnectionError('<pip._vendor.urllib3.connection.HTTPSConnection object at 0x0000020BABF8FC10>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /simple/pyaml/
WARNING: Retrying (Retry(total=3, connect=None, read=None, redirect=None, status=None)) after connection broken by 'NewConnectionError('<pip._vendor.urllib3.connection.HTTPSConnection object at 0x0000020BAFD84690>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /simple/pyaml/
WARNING: Retrying (Retry(total=2, connect=None, read=None, redirect=None, status=None)) after connection broken by 'NewConnectionError('<pip._vendor.urllib3.connection.HTTPSConnection object at 0x0000020BAFD84C90>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /simple/pyaml/
WARNING: Retrying (Retry(total=1, connect=None, read=None, redirect=None, status=None)) after connection broken by 'NewConnectionError('<pip._vendor.urllib3.connection.HTTPSConnection object at 0x0000020BAFD85550>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /simple/pyaml/
WARNING: Retrying (Retry(total=0, connect=None, read=None, redirect=None, status=None)) after connection broken by 'NewConnectionError('<pip._vendor.urllib3.connection.HTTPSConnection object at 0x0000020BAFD85F90>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /simple/pyaml/
ERROR: Could not find a version that satisfies the requirement pyaml (from versions: none)
ERROR: No matching distribution found for pyaml
WARNING: Retrying (Retry(total=4, connect=None, read=None, redirect=None, status=None)) after connection broken by 'NewConnectionError('<pip._vendor.urllib3.connection.HTTPSConnection object at 0x000001DC9B9C2BD0>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /simple/atom-openmm/
WARNING: Retrying (Retry(total=3, connect=None, read=None, redirect=None, status=None)) after connection broken by 'NewConnectionError('<pip._vendor.urllib3.connection.HTTPSConnection object at 0x000001DC9BB02490>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /simple/atom-openmm/
WARNING: Retrying (Retry(total=2, connect=None, read=None, redirect=None, status=None)) after connection broken by 'NewConnectionError('<pip._vendor.urllib3.connection.HTTPSConnection object at 0x000001DC9BB02DD0>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /simple/atom-openmm/
WARNING: Retrying (Retry(total=1, connect=None, read=None, redirect=None, status=None)) after connection broken by 'NewConnectionError('<pip._vendor.urllib3.connection.HTTPSConnection object at 0x000001DC9BB03950>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /simple/atom-openmm/
WARNING: Retrying (Retry(total=0, connect=None, read=None, redirect=None, status=None)) after connection broken by 'NewConnectionError('<pip._vendor.urllib3.connection.HTTPSConnection object at 0x000001DC9BB1C5D0>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /simple/atom-openmm/
ERROR: Could not find a version that satisfies the requirement atom-openmm (from versions: none)
ERROR: No matching distribution found for atom-openmm
python.exe: can't open file 'C:\\ProgramData\\BOINC\\slots\\2\\Scripts\\rbfe_production.exe': [Errno 2] No such file or directory
23:35:46 (9696): C:/Windows/system32/cmd.exe exited; CPU time 1.343750
23:35:46 (9696): app exit status: 0x16
23:35:46 (9696): 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: 527325 bytes.
Dumping objects ->
{3835470} normal block at 0x000001ED9EEBD7A0, 48 bytes long.
 Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835459} normal block at 0x000001ED9EEBD960, 48 bytes long.
 Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835448} normal block at 0x000001ED9EEBDF10, 48 bytes long.
 Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61 
{3835437} normal block at 0x000001ED9EEBDCE0, 48 bytes long.
 Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835426} normal block at 0x000001ED9D1B5020, 48 bytes long.
 Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61 
{3835395} normal block at 0x000001ED9EF0BB40, 64 bytes long.
 Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835384} normal block at 0x000001ED9EF1F030, 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) : {3835381} normal block at 0x000001ED9D1ADCF0, 8 bytes long.
 Data: <  g &#237;   > 00 00 67 9D ED 01 00 00 
{3834660} normal block at 0x000001ED9EF1F660, 102 bytes long.
 Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65 
{3833965} normal block at 0x000001ED9D1ADFC0, 8 bytes long.
 Data: <`&#220;  &#237;   > 60 DC 19 9D ED 01 00 00 
..\zip\boinc_zip.cpp(122) : {314} normal block at 0x000001ED9D1A1A50, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{299} normal block at 0x000001ED9D1A1F00, 80 bytes long.
 Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C 
{298} normal block at 0x000001ED9D1B62F0, 16 bytes long.
 Data: <&#216;p  &#237;           > D8 70 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{297} normal block at 0x000001ED9D1B6B60, 16 bytes long.
 Data: <&#176;p  &#237;           > B0 70 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{296} normal block at 0x000001ED9D1B09B0, 32 bytes long.
 Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D 
{295} normal block at 0x000001ED9D1B5F30, 16 bytes long.
 Data: < p  &#237;           > 88 70 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{294} normal block at 0x000001ED9D1B6C50, 16 bytes long.
 Data: <`p  &#237;           > 60 70 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{293} normal block at 0x000001ED9D1B6110, 16 bytes long.
 Data: <8p  &#237;           > 38 70 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{292} normal block at 0x000001ED9D1B69D0, 16 bytes long.
 Data: < p  &#237;           > 10 70 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{291} normal block at 0x000001ED9D1B5100, 48 bytes long.
 Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F 
{290} normal block at 0x000001ED9D1B6D40, 16 bytes long.
 Data: <&#184;&#247;  &#237;           > B8 F7 19 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{289} normal block at 0x000001ED9D1B0830, 32 bytes long.
 Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69 
{288} normal block at 0x000001ED9D1B6520, 16 bytes long.
 Data: < &#247;  &#237;           > 90 F7 19 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{286} normal block at 0x000001ED9D1B6CF0, 16 bytes long.
 Data: <h&#247;  &#237;           > 68 F7 19 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x000001ED9D1B64D0, 16 bytes long.
 Data: <@&#247;  &#237;           > 40 F7 19 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{284} normal block at 0x000001ED9D1B6570, 16 bytes long.
 Data: < &#247;  &#237;           > 18 F7 19 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{283} normal block at 0x000001ED9D1B62A0, 16 bytes long.
 Data: <&#240;&#246;  &#237;           > F0 F6 19 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x000001ED9D1B6200, 16 bytes long.
 Data: <&#200;&#246;  &#237;           > C8 F6 19 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{281} normal block at 0x000001ED9D1AFED0, 32 bytes long.
 Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55 
{280} normal block at 0x000001ED9D1B6B10, 16 bytes long.
 Data: <&#160;&#246;  &#237;           > A0 F6 19 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{279} normal block at 0x000001ED9D19F6A0, 320 bytes long.
 Data: < k  &#237;   &#208;&#254;  &#237;   > 10 6B 1B 9D ED 01 00 00 D0 FE 1A 9D ED 01 00 00 
{278} normal block at 0x000001ED9D1B5E90, 16 bytes long.
 Data: <&#240;o  &#237;           > F0 6F 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{277} normal block at 0x000001ED9D1B6070, 16 bytes long.
 Data: <&#200;o  &#237;           > C8 6F 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{276} normal block at 0x000001ED9D1B0770, 32 bytes long.
 Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65 
{275} normal block at 0x000001ED9D1B6C00, 16 bytes long.
 Data: <&#160;o  &#237;           > A0 6F 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{274} normal block at 0x000001ED9D1B0A70, 32 bytes long.
 Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62 
{273} normal block at 0x000001ED9D1B68E0, 16 bytes long.
 Data: <&#232;n  &#237;           > E8 6E 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{272} normal block at 0x000001ED9D1B6340, 16 bytes long.
 Data: <&#192;n  &#237;           > C0 6E 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{271} normal block at 0x000001ED9D1B6CA0, 16 bytes long.
 Data: < n  &#237;           > 98 6E 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x000001ED9D1B5F80, 16 bytes long.
 Data: <pn  &#237;           > 70 6E 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{269} normal block at 0x000001ED9D1B6AC0, 16 bytes long.
 Data: <Hn  &#237;           > 48 6E 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x000001ED9D1B6980, 16 bytes long.
 Data: < n  &#237;           > 20 6E 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{266} normal block at 0x000001ED9D1B6750, 16 bytes long.
 Data: <&#224;Q  &#237;           > E0 51 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{265} normal block at 0x000001ED9D1B51E0, 40 bytes long.
 Data: <Pg  &#237;   @&#187;&#240;&#158;&#237;   > 50 67 1B 9D ED 01 00 00 40 BB F0 9E ED 01 00 00 
{264} normal block at 0x000001ED9D1B6480, 16 bytes long.
 Data: < n  &#237;           > 00 6E 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{263} normal block at 0x000001ED9D1B66B0, 16 bytes long.
 Data: <&#216;m  &#237;           > D8 6D 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{262} normal block at 0x000001ED9D1B0530, 32 bytes long.
 Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F 
{261} normal block at 0x000001ED9D1B65C0, 16 bytes long.
 Data: <&#176;m  &#237;           > B0 6D 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{260} normal block at 0x000001ED9D1B6DB0, 992 bytes long.
 Data: <&#192;e  &#237;   0   &#237;   > C0 65 1B 9D ED 01 00 00 30 05 1B 9D ED 01 00 00 
{96} normal block at 0x000001ED9D1B0890, 32 bytes long.
 Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F 
{95} normal block at 0x000001ED9D1ADF70, 16 bytes long.
 Data: <pQ  &#237;           > 70 51 1B 9D ED 01 00 00 00 00 00 00 00 00 00 00 
{94} normal block at 0x000001ED9D1B5170, 40 bytes long.
 Data: <p&#223;  &#237;       &#237;   > 70 DF 1A 9D ED 01 00 00 90 08 1B 9D ED 01 00 00 
{73} normal block at 0x000001ED9D1AD930, 16 bytes long.
 Data: < &#234;&#254;X&#246;           > 80 EA FE 58 F6 7F 00 00 00 00 00 00 00 00 00 00 
{72} normal block at 0x000001ED9D1ADED0, 16 bytes long.
 Data: <@&#233;&#254;X&#246;           > 40 E9 FE 58 F6 7F 00 00 00 00 00 00 00 00 00 00 
{71} normal block at 0x000001ED9D1ADC50, 16 bytes long.
 Data: <&#248;W&#251;X&#246;           > F8 57 FB 58 F6 7F 00 00 00 00 00 00 00 00 00 00 
{70} normal block at 0x000001ED9D1ADE30, 16 bytes long.
 Data: <&#216;W&#251;X&#246;           > D8 57 FB 58 F6 7F 00 00 00 00 00 00 00 00 00 00 
{69} normal block at 0x000001ED9D1AE600, 16 bytes long.
 Data: <P &#251;X&#246;           > 50 04 FB 58 F6 7F 00 00 00 00 00 00 00 00 00 00 
{68} normal block at 0x000001ED9D1AE7E0, 16 bytes long.
 Data: <0 &#251;X&#246;           > 30 04 FB 58 F6 7F 00 00 00 00 00 00 00 00 00 00 
{67} normal block at 0x000001ED9D1AE5B0, 16 bytes long.
 Data: <&#224; &#251;X&#246;           > E0 02 FB 58 F6 7F 00 00 00 00 00 00 00 00 00 00 
{66} normal block at 0x000001ED9D1AE290, 16 bytes long.
 Data: <  &#251;X&#246;           > 10 04 FB 58 F6 7F 00 00 00 00 00 00 00 00 00 00 
{65} normal block at 0x000001ED9D1AE010, 16 bytes long.
 Data: <p &#251;X&#246;           > 70 04 FB 58 F6 7F 00 00 00 00 00 00 00 00 00 00 
{64} normal block at 0x000001ED9D1ADBB0, 16 bytes long.
 Data: < &#192;&#249;X&#246;           > 18 C0 F9 58 F6 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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