Task 38612521

Name PTP1B_A01_A23_r0_5-QUICO_ATM_GAFF2_NAGL_PTP1B-4-6-RND4546_0
Workunit 31565122
Created 16 Apr 2026, 8:16:59 UTC
Sent 16 Apr 2026, 8:17:00 UTC
Report deadline 21 Apr 2026, 8:17:00 UTC
Received 16 Apr 2026, 16:29:04 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 651099
Run time 1 min 55 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 40.36 MB
Peak swap size 28.02 MB
Peak disk usage 1.46 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>
18:26:56 (12744): wrapper (7.9.26016): starting
18:26:56 (12744): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A01_A23_0.pdb
QB_A01_A23_0.xml
QB_A01_A23.inpcrd
QB_A01_A23_input.yaml
QB_A01_A23.pdb
QB_A01_A23.prmtop
QB_A01_A23_sys.xml
run.bat
run.sh
18:26:57 (12744): Library/usr/bin/tar.exe exited; CPU time 0.000000
18:26:57 (12744): 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 0x000001D4F8CE3B50>: 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 0x000001D4F8CE4290>: 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 0x000001D4F8CE4950>: 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 0x000001D4F8CE52D0>: 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 0x000001D4F8CE5D10>: 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 0x000001A988CE2BD0>: 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 0x000001A988E22490>: 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 0x000001A988E22DD0>: 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 0x000001A988E23950>: 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 0x000001A988E3C5D0>: 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\\1\\Scripts\\rbfe_production.exe': [Errno 2] No such file or directory
18:27:21 (12744): C:/Windows/system32/cmd.exe exited; CPU time 1.312500
18:27:21 (12744): app exit status: 0x16
18:27:21 (12744): 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: 478525 bytes.
Dumping objects ->
{3835470} normal block at 0x00000220D41AD610, 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 0x00000220D41AE090, 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 0x00000220D41ADA70, 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 0x00000220D41ADFB0, 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 0x00000220D25E4D50, 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 0x00000220D41F57B0, 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 0x00000220D420EED0, 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 0x00000220D25DDE40, 8 bytes long.
 Data: <  [&#210;    > 00 00 5B D2 20 02 00 00 
{3834660} normal block at 0x00000220D420F2F0, 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 0x00000220D25DDC60, 8 bytes long.
 Data: <&#240;&#230; &#212;    > F0 E6 20 D4 20 02 00 00 
..\zip\boinc_zip.cpp(122) : {314} normal block at 0x00000220D25D25B0, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{299} normal block at 0x00000220D25CFA20, 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 0x00000220D25E6210, 16 bytes long.
 Data: <(m^&#210;            > 28 6D 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{297} normal block at 0x00000220D25E5EF0, 16 bytes long.
 Data: < m^&#210;            > 00 6D 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{296} normal block at 0x00000220D25E0600, 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 0x00000220D25E6670, 16 bytes long.
 Data: <&#216;l^&#210;            > D8 6C 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{294} normal block at 0x00000220D25E6120, 16 bytes long.
 Data: <&#176;l^&#210;            > B0 6C 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{293} normal block at 0x00000220D25E5EA0, 16 bytes long.
 Data: < l^&#210;            > 88 6C 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{292} normal block at 0x00000220D25E65D0, 16 bytes long.
 Data: <`l^&#210;            > 60 6C 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{291} normal block at 0x00000220D25E5140, 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 0x00000220D25E5AE0, 16 bytes long.
 Data: < ,]&#210;            > 88 2C 5D D2 20 02 00 00 00 00 00 00 00 00 00 00 
{289} normal block at 0x00000220D25DF880, 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 0x00000220D25E6580, 16 bytes long.
 Data: <`,]&#210;            > 60 2C 5D D2 20 02 00 00 00 00 00 00 00 00 00 00 
{286} normal block at 0x00000220D25E6800, 16 bytes long.
 Data: <8,]&#210;            > 38 2C 5D D2 20 02 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x00000220D25E5DB0, 16 bytes long.
 Data: < ,]&#210;            > 10 2C 5D D2 20 02 00 00 00 00 00 00 00 00 00 00 
{284} normal block at 0x00000220D25E6030, 16 bytes long.
 Data: <&#232;+]&#210;            > E8 2B 5D D2 20 02 00 00 00 00 00 00 00 00 00 00 
{283} normal block at 0x00000220D25E5FE0, 16 bytes long.
 Data: <&#192;+]&#210;            > C0 2B 5D D2 20 02 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x00000220D25E5F90, 16 bytes long.
 Data: < +]&#210;            > 98 2B 5D D2 20 02 00 00 00 00 00 00 00 00 00 00 
{281} normal block at 0x00000220D25DFEE0, 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 0x00000220D25E68A0, 16 bytes long.
 Data: <p+]&#210;            > 70 2B 5D D2 20 02 00 00 00 00 00 00 00 00 00 00 
{279} normal block at 0x00000220D25D2B70, 320 bytes long.
 Data: <&#160;h^&#210;    &#224;&#254;]&#210;    > A0 68 5E D2 20 02 00 00 E0 FE 5D D2 20 02 00 00 
{278} normal block at 0x00000220D25E6620, 16 bytes long.
 Data: <@l^&#210;            > 40 6C 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{277} normal block at 0x00000220D25E5E50, 16 bytes long.
 Data: < l^&#210;            > 18 6C 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{276} normal block at 0x00000220D25DFE80, 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 0x00000220D25E5D60, 16 bytes long.
 Data: <&#240;k^&#210;            > F0 6B 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{274} normal block at 0x00000220D25DFE20, 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 0x00000220D25E6490, 16 bytes long.
 Data: <8k^&#210;            > 38 6B 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{272} normal block at 0x00000220D25E5F40, 16 bytes long.
 Data: < k^&#210;            > 10 6B 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{271} normal block at 0x00000220D25E6530, 16 bytes long.
 Data: <&#232;j^&#210;            > E8 6A 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x00000220D25E6760, 16 bytes long.
 Data: <&#192;j^&#210;            > C0 6A 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{269} normal block at 0x00000220D25E6440, 16 bytes long.
 Data: < j^&#210;            > 98 6A 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x00000220D25E63F0, 16 bytes long.
 Data: <pj^&#210;            > 70 6A 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{266} normal block at 0x00000220D25E6710, 16 bytes long.
 Data: < O^&#210;            > 10 4F 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{265} normal block at 0x00000220D25E4F10, 40 bytes long.
 Data: < g^&#210;    &#176;W &#212;    > 10 67 5E D2 20 02 00 00 B0 57 1F D4 20 02 00 00 
{264} normal block at 0x00000220D25E63A0, 16 bytes long.
 Data: <Pj^&#210;            > 50 6A 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{263} normal block at 0x00000220D25E5A90, 16 bytes long.
 Data: <(j^&#210;            > 28 6A 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{262} normal block at 0x00000220D25DFD60, 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 0x00000220D25E62B0, 16 bytes long.
 Data: < j^&#210;            > 00 6A 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{260} normal block at 0x00000220D25E6A00, 992 bytes long.
 Data: <&#176;b^&#210;    `&#253;]&#210;    > B0 62 5E D2 20 02 00 00 60 FD 5D D2 20 02 00 00 
{96} normal block at 0x00000220D25DFB80, 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 0x00000220D25DDD00, 16 bytes long.
 Data: <&#224;L^&#210;            > E0 4C 5E D2 20 02 00 00 00 00 00 00 00 00 00 00 
{94} normal block at 0x00000220D25E4CE0, 40 bytes long.
 Data: < &#221;]&#210;     &#251;]&#210;    > 00 DD 5D D2 20 02 00 00 80 FB 5D D2 20 02 00 00 
{73} normal block at 0x00000220D25DD9E0, 16 bytes long.
 Data: < &#234;&#217;&#130;&#246;           > 80 EA D9 82 F6 7F 00 00 00 00 00 00 00 00 00 00 
{72} normal block at 0x00000220D25DD710, 16 bytes long.
 Data: <@&#233;&#217;&#130;&#246;           > 40 E9 D9 82 F6 7F 00 00 00 00 00 00 00 00 00 00 
{71} normal block at 0x00000220D25DD990, 16 bytes long.
 Data: <&#248;W&#214;&#130;&#246;           > F8 57 D6 82 F6 7F 00 00 00 00 00 00 00 00 00 00 
{70} normal block at 0x00000220D25DE110, 16 bytes long.
 Data: <&#216;W&#214;&#130;&#246;           > D8 57 D6 82 F6 7F 00 00 00 00 00 00 00 00 00 00 
{69} normal block at 0x00000220D25DDBC0, 16 bytes long.
 Data: <P &#214;&#130;&#246;           > 50 04 D6 82 F6 7F 00 00 00 00 00 00 00 00 00 00 
{68} normal block at 0x00000220D25DE1B0, 16 bytes long.
 Data: <0 &#214;&#130;&#246;           > 30 04 D6 82 F6 7F 00 00 00 00 00 00 00 00 00 00 
{67} normal block at 0x00000220D25DDB70, 16 bytes long.
 Data: <&#224; &#214;&#130;&#246;           > E0 02 D6 82 F6 7F 00 00 00 00 00 00 00 00 00 00 
{66} normal block at 0x00000220D25DD670, 16 bytes long.
 Data: <  &#214;&#130;&#246;           > 10 04 D6 82 F6 7F 00 00 00 00 00 00 00 00 00 00 
{65} normal block at 0x00000220D25DDEE0, 16 bytes long.
 Data: <p &#214;&#130;&#246;           > 70 04 D6 82 F6 7F 00 00 00 00 00 00 00 00 00 00 
{64} normal block at 0x00000220D25DD5D0, 16 bytes long.
 Data: < &#192;&#212;&#130;&#246;           > 18 C0 D4 82 F6 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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