Task 38628932

Name cdk8_A26_A01_r0_4-QUICO_ATM_OpenFF23_NAGL_cdk8-2-6-RND0674_0
Workunit 31578498
Created 24 Apr 2026, 23:27:13 UTC
Sent 24 Apr 2026, 23:27:19 UTC
Report deadline 29 Apr 2026, 23:27:19 UTC
Received 26 Apr 2026, 14:27:06 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 608046
Run time 1 min 40 sec
CPU time 2 sec
Validate state Invalid
Credit 0.00
Device peak FLOPS 58,716.15 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 52.25 MB
Peak swap size 37.68 MB
Peak disk usage 1.61 GB

Stderr output

<core_client_version>8.2.9</core_client_version>
<![CDATA[
<message>
K�ytt�j�rjestelm� ei voi suorittaa ohjelmaa (null).
 (0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
16:52:53 (37728): wrapper (7.9.26016): starting
16:52:53 (37728): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A26_A01_0.pdb
QB_A26_A01_0.xml
QB_A26_A01.inpcrd
QB_A26_A01_input.yaml
QB_A26_A01.pdb
QB_A26_A01.prmtop
QB_A26_A01_sys.xml
run.bat
run.sh
16:52:55 (37728): Library/usr/bin/tar.exe exited; CPU time 0.000000
16:52:55 (37728): 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 0x000001EADBA7FFD0>: 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 0x000001EADBA8C790>: 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 0x000001EADBA8D0D0>: 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 0x000001EADBA8D890>: 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 0x000001EADBA8E210>: 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 0x0000021CD7949610>: 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 0x0000021CD794A050>: 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 0x0000021CD794AB10>: 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 0x0000021CD794B710>: 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 0x0000021CD7968350>: 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
16:53:29 (37728): C:/Windows/system32/cmd.exe exited; CPU time 2.312500
16:53:29 (37728): app exit status: 0x16
16:53:29 (37728): 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: 1146077 bytes.
Dumping objects ->
{3835611} normal block at 0x0000025D16691100, 48 bytes long.
 Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835600} normal block at 0x0000025D16691560, 48 bytes long.
 Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835589} normal block at 0x0000025D16691020, 48 bytes long.
 Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61 
{3835578} normal block at 0x0000025D16690A70, 48 bytes long.
 Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835567} normal block at 0x0000025D166914F0, 48 bytes long.
 Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61 
{3835536} normal block at 0x0000025D167860F0, 64 bytes long.
 Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
..\api\boinc_api.cpp(309) : {3835523} normal block at 0x0000025D14C0E670, 8 bytes long.
 Data: <  &#239; ]   > 00 00 EF 14 5D 02 00 00 
{3833977} normal block at 0x0000025D14C0E120, 8 bytes long.
 Data: <`V  ]   > 60 56 81 16 5D 02 00 00 
..\zip\boinc_zip.cpp(122) : {320} normal block at 0x0000025D14C015E0, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{305} normal block at 0x0000025D14C024E0, 80 bytes long.
 Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C 
{304} normal block at 0x0000025D14C16D80, 16 bytes long.
 Data: < x&#193; ]           > 98 78 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{303} normal block at 0x0000025D14C16B00, 16 bytes long.
 Data: <px&#193; ]           > 70 78 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{302} normal block at 0x0000025D14C10120, 32 bytes long.
 Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D 
{301} normal block at 0x0000025D14C16AB0, 16 bytes long.
 Data: <Hx&#193; ]           > 48 78 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{300} normal block at 0x0000025D14C16D30, 16 bytes long.
 Data: < x&#193; ]           > 20 78 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{299} normal block at 0x0000025D14C17370, 16 bytes long.
 Data: <&#248;w&#193; ]           > F8 77 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{298} normal block at 0x0000025D14C16BA0, 16 bytes long.
 Data: <&#208;w&#193; ]           > D0 77 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{297} normal block at 0x0000025D14C11240, 48 bytes long.
 Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F 
{296} normal block at 0x0000025D14C17460, 16 bytes long.
 Data: <&#200;&#250;&#191; ]           > C8 FA BF 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{295} normal block at 0x0000025D14C10780, 32 bytes long.
 Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69 
{294} normal block at 0x0000025D14C174B0, 16 bytes long.
 Data: <&#160;&#250;&#191; ]           > A0 FA BF 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{292} normal block at 0x0000025D14C169C0, 16 bytes long.
 Data: <x&#250;&#191; ]           > 78 FA BF 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{291} normal block at 0x0000025D14C16920, 16 bytes long.
 Data: <P&#250;&#191; ]           > 50 FA BF 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{290} normal block at 0x0000025D14C166F0, 16 bytes long.
 Data: <(&#250;&#191; ]           > 28 FA BF 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{289} normal block at 0x0000025D14C170A0, 16 bytes long.
 Data: < &#250;&#191; ]           > 00 FA BF 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{288} normal block at 0x0000025D14C16F10, 16 bytes long.
 Data: <&#216;&#249;&#191; ]           > D8 F9 BF 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{287} normal block at 0x0000025D14C105A0, 32 bytes long.
 Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55 
{286} normal block at 0x0000025D14C168D0, 16 bytes long.
 Data: <&#176;&#249;&#191; ]           > B0 F9 BF 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x0000025D14BFF9B0, 320 bytes long.
 Data: <&#208;h&#193; ]   &#160; &#193; ]   > D0 68 C1 14 5D 02 00 00 A0 05 C1 14 5D 02 00 00 
{284} normal block at 0x0000025D14C16F60, 16 bytes long.
 Data: <&#176;w&#193; ]           > B0 77 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{283} normal block at 0x0000025D14C17410, 16 bytes long.
 Data: < w&#193; ]           > 88 77 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x0000025D14C10960, 32 bytes long.
 Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65 
{281} normal block at 0x0000025D14C16CE0, 16 bytes long.
 Data: <`w&#193; ]           > 60 77 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{280} normal block at 0x0000025D14C10000, 32 bytes long.
 Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62 
{279} normal block at 0x0000025D14C166A0, 16 bytes long.
 Data: <&#168;v&#193; ]           > A8 76 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{278} normal block at 0x0000025D14C16650, 16 bytes long.
 Data: < v&#193; ]           > 80 76 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{277} normal block at 0x0000025D14C16C90, 16 bytes long.
 Data: <Xv&#193; ]           > 58 76 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{276} normal block at 0x0000025D14C172D0, 16 bytes long.
 Data: <0v&#193; ]           > 30 76 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{275} normal block at 0x0000025D14C17500, 16 bytes long.
 Data: < v&#193; ]           > 08 76 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{274} normal block at 0x0000025D14C16830, 16 bytes long.
 Data: <&#224;u&#193; ]           > E0 75 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{272} normal block at 0x0000025D14C16740, 16 bytes long.
 Data: <  &#193; ]           > 80 10 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{271} normal block at 0x0000025D14C11080, 40 bytes long.
 Data: <@g&#193; ]   &#240;`x ]   > 40 67 C1 14 5D 02 00 00 F0 60 78 16 5D 02 00 00 
{270} normal block at 0x0000025D14C16600, 16 bytes long.
 Data: <&#192;u&#193; ]           > C0 75 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{269} normal block at 0x0000025D14C16790, 16 bytes long.
 Data: < u&#193; ]           > 98 75 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x0000025D14C10300, 32 bytes long.
 Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F 
{267} normal block at 0x0000025D14C16A60, 16 bytes long.
 Data: <pu&#193; ]           > 70 75 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{266} normal block at 0x0000025D14C17570, 992 bytes long.
 Data: <`j&#193; ]     &#193; ]   > 60 6A C1 14 5D 02 00 00 00 03 C1 14 5D 02 00 00 
{102} normal block at 0x0000025D14C10E40, 32 bytes long.
 Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F 
{101} normal block at 0x0000025D14C0E030, 16 bytes long.
 Data: <0 &#193; ]           > 30 16 C1 14 5D 02 00 00 00 00 00 00 00 00 00 00 
{100} normal block at 0x0000025D14C11630, 40 bytes long.
 Data: <0&#224;&#192; ]   @ &#193; ]   > 30 E0 C0 14 5D 02 00 00 40 0E C1 14 5D 02 00 00 
{79} normal block at 0x0000025D14C0EAD0, 16 bytes long.
 Data: < &#234;:&#145;&#247;           > 80 EA 3A 91 F7 7F 00 00 00 00 00 00 00 00 00 00 
{78} normal block at 0x0000025D14C0EA30, 16 bytes long.
 Data: <@&#233;:&#145;&#247;           > 40 E9 3A 91 F7 7F 00 00 00 00 00 00 00 00 00 00 
{77} normal block at 0x0000025D14C0DE50, 16 bytes long.
 Data: <&#248;W7&#145;&#247;           > F8 57 37 91 F7 7F 00 00 00 00 00 00 00 00 00 00 
{76} normal block at 0x0000025D14C0E9E0, 16 bytes long.
 Data: <&#216;W7&#145;&#247;           > D8 57 37 91 F7 7F 00 00 00 00 00 00 00 00 00 00 
{75} normal block at 0x0000025D14C0E850, 16 bytes long.
 Data: <P 7&#145;&#247;           > 50 04 37 91 F7 7F 00 00 00 00 00 00 00 00 00 00 
{74} normal block at 0x0000025D14C0E990, 16 bytes long.
 Data: <0 7&#145;&#247;           > 30 04 37 91 F7 7F 00 00 00 00 00 00 00 00 00 00 
{73} normal block at 0x0000025D14C0E440, 16 bytes long.
 Data: <&#224; 7&#145;&#247;           > E0 02 37 91 F7 7F 00 00 00 00 00 00 00 00 00 00 
{72} normal block at 0x0000025D14C0E080, 16 bytes long.
 Data: <  7&#145;&#247;           > 10 04 37 91 F7 7F 00 00 00 00 00 00 00 00 00 00 
{71} normal block at 0x0000025D14C0DE00, 16 bytes long.
 Data: <p 7&#145;&#247;           > 70 04 37 91 F7 7F 00 00 00 00 00 00 00 00 00 00 
{70} normal block at 0x0000025D14C0E6C0, 16 bytes long.
 Data: < &#192;5&#145;&#247;           > 18 C0 35 91 F7 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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