Task 38605380

Name tnks2_A08_A14_r0_5-QUICO_ATM_GAFF2_NAGL_TNKS2-1-6-RND2863_0
Workunit 31559282
Created 13 Apr 2026, 16:12:43 UTC
Sent 13 Apr 2026, 16:12:44 UTC
Report deadline 18 Apr 2026, 16:12:44 UTC
Received 14 Apr 2026, 5:06:40 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 651090
Run time 1 min 17 sec
CPU time 1 sec
Validate state Invalid
Credit 0.00
Device peak FLOPS 11,343.27 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 49.84 MB
Peak swap size 36.06 MB
Peak disk usage 1.55 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>
03:39:07 (5328): wrapper (7.9.26016): starting
03:39:07 (5328): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A08_A14_0.pdb
QB_A08_A14_0.xml
QB_A08_A14.inpcrd
QB_A08_A14_input.yaml
QB_A08_A14.pdb
QB_A08_A14.prmtop
QB_A08_A14_sys.xml
run.bat
run.sh
03:39:08 (5328): Library/usr/bin/tar.exe exited; CPU time 0.000000
03:39:08 (5328): 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 0x0000011CF1FDFC10>: 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 0x0000011CF5D94910>: 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 0x0000011CF5D95150>: 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 0x0000011CF5D957D0>: 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 0x0000011CF5D961D0>: 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 0x0000025DDD892BD0>: 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 0x0000025DDD9D2350>: 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 0x0000025DDD9D2D50>: 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 0x0000025DDD9D3850>: 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 0x0000025DDD9EC4D0>: 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\\0\\Scripts\\rbfe_production.exe': [Errno 2] No such file or directory
03:39:32 (5328): C:/Windows/system32/cmd.exe exited; CPU time 1.609375
03:39:32 (5328): app exit status: 0x16
03:39:32 (5328): 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: 484445 bytes.
Dumping objects ->
{3835233} normal block at 0x0000029298C1C8D0, 48 bytes long.
 Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835222} normal block at 0x0000029298C1C780, 48 bytes long.
 Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835211} normal block at 0x0000029296E14C50, 48 bytes long.
 Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61 
{3835200} normal block at 0x0000029296E14B00, 48 bytes long.
 Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835189} normal block at 0x0000029296E14DA0, 48 bytes long.
 Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61 
{3835158} normal block at 0x0000029298C67220, 64 bytes long.
 Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835147} normal block at 0x0000029298C7EF50, 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) : {3835144} normal block at 0x0000029296E0D800, 8 bytes long.
 Data: <  #&#151;&#146;   > 00 00 23 97 92 02 00 00 
{3834547} normal block at 0x0000029298C7E660, 102 bytes long.
 Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65 
{3833969} normal block at 0x0000029296E0D3F0, 8 bytes long.
 Data: < &#217;&#223;&#150;&#146;   > 10 D9 DF 96 92 02 00 00 
..\zip\boinc_zip.cpp(122) : {316} normal block at 0x0000029296E00BC0, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{301} normal block at 0x0000029296E02300, 80 bytes long.
 Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C 
{300} normal block at 0x0000029296E15E50, 16 bytes long.
 Data: <Hk&#225;&#150;&#146;           > 48 6B E1 96 92 02 00 00 00 00 00 00 00 00 00 00 
{299} normal block at 0x0000029296E15D60, 16 bytes long.
 Data: < k&#225;&#150;&#146;           > 20 6B E1 96 92 02 00 00 00 00 00 00 00 00 00 00 
{298} normal block at 0x0000029296E0FA60, 32 bytes long.
 Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D 
{297} normal block at 0x0000029296E15D10, 16 bytes long.
 Data: <&#248;j&#225;&#150;&#146;           > F8 6A E1 96 92 02 00 00 00 00 00 00 00 00 00 00 
{296} normal block at 0x0000029296E15B30, 16 bytes long.
 Data: <&#208;j&#225;&#150;&#146;           > D0 6A E1 96 92 02 00 00 00 00 00 00 00 00 00 00 
{295} normal block at 0x0000029296E15AE0, 16 bytes long.
 Data: <&#168;j&#225;&#150;&#146;           > A8 6A E1 96 92 02 00 00 00 00 00 00 00 00 00 00 
{294} normal block at 0x0000029296E159F0, 16 bytes long.
 Data: < j&#225;&#150;&#146;           > 80 6A E1 96 92 02 00 00 00 00 00 00 00 00 00 00 
{293} normal block at 0x0000029296E14FD0, 48 bytes long.
 Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F 
{292} normal block at 0x0000029296E15E00, 16 bytes long.
 Data: <h&#244;&#223;&#150;&#146;           > 68 F4 DF 96 92 02 00 00 00 00 00 00 00 00 00 00 
{291} normal block at 0x0000029296E10480, 32 bytes long.
 Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69 
{290} normal block at 0x0000029296E158B0, 16 bytes long.
 Data: <@&#244;&#223;&#150;&#146;           > 40 F4 DF 96 92 02 00 00 00 00 00 00 00 00 00 00 
{288} normal block at 0x0000029296E15CC0, 16 bytes long.
 Data: < &#244;&#223;&#150;&#146;           > 18 F4 DF 96 92 02 00 00 00 00 00 00 00 00 00 00 
{287} normal block at 0x0000029296E161C0, 16 bytes long.
 Data: <&#240;&#243;&#223;&#150;&#146;           > F0 F3 DF 96 92 02 00 00 00 00 00 00 00 00 00 00 
{286} normal block at 0x0000029296E167B0, 16 bytes long.
 Data: <&#200;&#243;&#223;&#150;&#146;           > C8 F3 DF 96 92 02 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x0000029296E16170, 16 bytes long.
 Data: <&#160;&#243;&#223;&#150;&#146;           > A0 F3 DF 96 92 02 00 00 00 00 00 00 00 00 00 00 
{284} normal block at 0x0000029296E159A0, 16 bytes long.
 Data: <x&#243;&#223;&#150;&#146;           > 78 F3 DF 96 92 02 00 00 00 00 00 00 00 00 00 00 
{283} normal block at 0x0000029296E0FF40, 32 bytes long.
 Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55 
{282} normal block at 0x0000029296E16760, 16 bytes long.
 Data: <P&#243;&#223;&#150;&#146;           > 50 F3 DF 96 92 02 00 00 00 00 00 00 00 00 00 00 
{281} normal block at 0x0000029296DFF350, 320 bytes long.
 Data: <`g&#225;&#150;&#146;   @&#255;&#224;&#150;&#146;   > 60 67 E1 96 92 02 00 00 40 FF E0 96 92 02 00 00 
{280} normal block at 0x0000029296E16120, 16 bytes long.
 Data: <`j&#225;&#150;&#146;           > 60 6A E1 96 92 02 00 00 00 00 00 00 00 00 00 00 
{279} normal block at 0x0000029296E160D0, 16 bytes long.
 Data: <8j&#225;&#150;&#146;           > 38 6A E1 96 92 02 00 00 00 00 00 00 00 00 00 00 
{278} normal block at 0x0000029296E0FBE0, 32 bytes long.
 Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65 
{277} normal block at 0x0000029296E15A90, 16 bytes long.
 Data: < j&#225;&#150;&#146;           > 10 6A E1 96 92 02 00 00 00 00 00 00 00 00 00 00 
{276} normal block at 0x0000029296E10360, 32 bytes long.
 Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62 
{275} normal block at 0x0000029296E15C70, 16 bytes long.
 Data: <Xi&#225;&#150;&#146;           > 58 69 E1 96 92 02 00 00 00 00 00 00 00 00 00 00 
{274} normal block at 0x0000029296E16530, 16 bytes long.
 Data: <0i&#225;&#150;&#146;           > 30 69 E1 96 92 02 00 00 00 00 00 00 00 00 00 00 
{273} normal block at 0x0000029296E16710, 16 bytes long.
 Data: < i&#225;&#150;&#146;           > 08 69 E1 96 92 02 00 00 00 00 00 00 00 00 00 00 
{272} normal block at 0x0000029296E16210, 16 bytes long.
 Data: <&#224;h&#225;&#150;&#146;           > E0 68 E1 96 92 02 00 00 00 00 00 00 00 00 00 00 
{271} normal block at 0x0000029296E166C0, 16 bytes long.
 Data: <&#184;h&#225;&#150;&#146;           > B8 68 E1 96 92 02 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x0000029296E16490, 16 bytes long.
 Data: < h&#225;&#150;&#146;           > 90 68 E1 96 92 02 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x0000029296E16030, 16 bytes long.
 Data: <&#192;L&#225;&#150;&#146;           > C0 4C E1 96 92 02 00 00 00 00 00 00 00 00 00 00 
{267} normal block at 0x0000029296E14CC0, 40 bytes long.
 Data: <0`&#225;&#150;&#146;    r&#198; &#146;   > 30 60 E1 96 92 02 00 00 20 72 C6 98 92 02 00 00 
{266} normal block at 0x0000029296E163A0, 16 bytes long.
 Data: <ph&#225;&#150;&#146;           > 70 68 E1 96 92 02 00 00 00 00 00 00 00 00 00 00 
{265} normal block at 0x0000029296E15C20, 16 bytes long.
 Data: <Hh&#225;&#150;&#146;           > 48 68 E1 96 92 02 00 00 00 00 00 00 00 00 00 00 
{264} normal block at 0x0000029296E0FB20, 32 bytes long.
 Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F 
{263} normal block at 0x0000029296E16260, 16 bytes long.
 Data: < h&#225;&#150;&#146;           > 20 68 E1 96 92 02 00 00 00 00 00 00 00 00 00 00 
{262} normal block at 0x0000029296E16820, 992 bytes long.
 Data: <`b&#225;&#150;&#146;    &#251;&#224;&#150;&#146;   > 60 62 E1 96 92 02 00 00 20 FB E0 96 92 02 00 00 
{98} normal block at 0x0000029296E0F8E0, 32 bytes long.
 Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F 
{97} normal block at 0x0000029296E0D440, 16 bytes long.
 Data: <P&#240;&#223;&#150;&#146;           > 50 F0 DF 96 92 02 00 00 00 00 00 00 00 00 00 00 
{96} normal block at 0x0000029296DFF050, 40 bytes long.
 Data: <@&#212;&#224;&#150;&#146;   &#224;&#248;&#224;&#150;&#146;   > 40 D4 E0 96 92 02 00 00 E0 F8 E0 96 92 02 00 00 
{75} normal block at 0x0000029296E0D350, 16 bytes long.
 Data: < &#234;&#146; &#247;           > 80 EA 92 06 F7 7F 00 00 00 00 00 00 00 00 00 00 
{74} normal block at 0x0000029296E0D8A0, 16 bytes long.
 Data: <@&#233;&#146; &#247;           > 40 E9 92 06 F7 7F 00 00 00 00 00 00 00 00 00 00 
{73} normal block at 0x0000029296E0E250, 16 bytes long.
 Data: <&#248;W  &#247;           > F8 57 8F 06 F7 7F 00 00 00 00 00 00 00 00 00 00 
{72} normal block at 0x0000029296E0DBC0, 16 bytes long.
 Data: <&#216;W  &#247;           > D8 57 8F 06 F7 7F 00 00 00 00 00 00 00 00 00 00 
{71} normal block at 0x0000029296E0D850, 16 bytes long.
 Data: <P   &#247;           > 50 04 8F 06 F7 7F 00 00 00 00 00 00 00 00 00 00 
{70} normal block at 0x0000029296E0D7B0, 16 bytes long.
 Data: <0   &#247;           > 30 04 8F 06 F7 7F 00 00 00 00 00 00 00 00 00 00 
{69} normal block at 0x0000029296E0DDF0, 16 bytes long.
 Data: <&#224;   &#247;           > E0 02 8F 06 F7 7F 00 00 00 00 00 00 00 00 00 00 
{68} normal block at 0x0000029296E0D710, 16 bytes long.
 Data: <    &#247;           > 10 04 8F 06 F7 7F 00 00 00 00 00 00 00 00 00 00 
{67} normal block at 0x0000029296E0E2A0, 16 bytes long.
 Data: <p   &#247;           > 70 04 8F 06 F7 7F 00 00 00 00 00 00 00 00 00 00 
{66} normal block at 0x0000029296E0DD50, 16 bytes long.
 Data: < &#192;  &#247;           > 18 C0 8D 06 F7 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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