Task 38632285

Name cdk8_A19_A03_r0_2-QUICO_ATM_GAFF2_NAGL_cdk8-2-6-RND6935_0
Workunit 31581218
Created 26 Apr 2026, 9:54:17 UTC
Sent 26 Apr 2026, 9:54:22 UTC
Report deadline 1 May 2026, 9:54:22 UTC
Received 26 Apr 2026, 10:02:44 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 645379
Run time 2 min 5 sec
CPU time 1 sec
Validate state Invalid
Credit 0.00
Device peak FLOPS 17,849.23 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 51.94 MB
Peak swap size 37.01 MB
Peak disk usage 1.51 GB

Stderr output

<core_client_version>8.2.9</core_client_version>
<![CDATA[
<message>
Das Betriebssystem kann (null) nicht ausf�hren.
 (0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
12:00:08 (25272): wrapper (7.9.26016): starting
12:00:08 (25272): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A19_A03_0.pdb
QB_A19_A03_0.xml
QB_A19_A03.inpcrd
QB_A19_A03_input.yaml
QB_A19_A03.pdb
QB_A19_A03.prmtop
QB_A19_A03_sys.xml
run.bat
run.sh
12:00:10 (25272): Library/usr/bin/tar.exe exited; CPU time 0.000000
12:00:10 (25272): 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 0x0000017D1557BA50>: Failed to establish a new connection: [WinError 10013] Der Zugriff auf einen Socket war aufgrund der Zugriffsrechte des Sockets unzul&#228;ssig')': /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 0x0000017D15584810>: Failed to establish a new connection: [WinError 10013] Der Zugriff auf einen Socket war aufgrund der Zugriffsrechte des Sockets unzul&#228;ssig')': /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 0x0000017D15584E50>: Failed to establish a new connection: [WinError 10013] Der Zugriff auf einen Socket war aufgrund der Zugriffsrechte des Sockets unzul&#228;ssig')': /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 0x0000017D15585810>: Failed to establish a new connection: [WinError 10013] Der Zugriff auf einen Socket war aufgrund der Zugriffsrechte des Sockets unzul&#228;ssig')': /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 0x0000017D15586250>: Failed to establish a new connection: [WinError 10013] Der Zugriff auf einen Socket war aufgrund der Zugriffsrechte des Sockets unzul&#228;ssig')': /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 0x000002A1DCA01150>: Failed to establish a new connection: [WinError 10013] Der Zugriff auf einen Socket war aufgrund der Zugriffsrechte des Sockets unzul&#228;ssig')': /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 0x000002A1DCA01F50>: Failed to establish a new connection: [WinError 10013] Der Zugriff auf einen Socket war aufgrund der Zugriffsrechte des Sockets unzul&#228;ssig')': /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 0x000002A1DCA02650>: Failed to establish a new connection: [WinError 10013] Der Zugriff auf einen Socket war aufgrund der Zugriffsrechte des Sockets unzul&#228;ssig')': /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 0x000002A1DCA03790>: Failed to establish a new connection: [WinError 10013] Der Zugriff auf einen Socket war aufgrund der Zugriffsrechte des Sockets unzul&#228;ssig')': /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 0x000002A1DCA1C090>: Failed to establish a new connection: [WinError 10013] Der Zugriff auf einen Socket war aufgrund der Zugriffsrechte des Sockets unzul&#228;ssig')': /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
12:00:44 (25272): C:/Windows/system32/cmd.exe exited; CPU time 1.468750
12:00:44 (25272): app exit status: 0x16
12:00:44 (25272): 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: 804201 bytes.
Dumping objects ->
{3835521} normal block at 0x000001D8D55BBD80, 48 bytes long.
 Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835510} normal block at 0x000001D8D55BC2C0, 48 bytes long.
 Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835499} normal block at 0x000001D8D55BCA30, 48 bytes long.
 Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61 
{3835488} normal block at 0x000001D8D55BC950, 48 bytes long.
 Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835477} normal block at 0x000001D8D55BC090, 48 bytes long.
 Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61 
{3835446} normal block at 0x000001D8D73583B0, 64 bytes long.
 Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835435} normal block at 0x000001D8D7371020, 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) : {3835432} normal block at 0x000001D8D558D8F0, 8 bytes long.
 Data: <  T&#213;&#216;   > 00 00 54 D5 D8 01 00 00 
{3834691} normal block at 0x000001D8D7371A70, 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 0x000001D8D558DD50, 8 bytes long.
 Data: < d;&#215;&#216;   > 80 64 3B D7 D8 01 00 00 
..\zip\boinc_zip.cpp(122) : {316} normal block at 0x000001D8D5584A80, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{301} normal block at 0x000001D8D5586FD0, 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 0x000001D8D5598E70, 16 bytes long.
 Data: <  Y&#213;&#216;           > 88 99 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{299} normal block at 0x000001D8D55989C0, 16 bytes long.
 Data: <` Y&#213;&#216;           > 60 99 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{298} normal block at 0x000001D8D5593F00, 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 0x000001D8D5598DD0, 16 bytes long.
 Data: <8 Y&#213;&#216;           > 38 99 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{296} normal block at 0x000001D8D55986F0, 16 bytes long.
 Data: <  Y&#213;&#216;           > 10 99 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{295} normal block at 0x000001D8D55995A0, 16 bytes long.
 Data: <&#232; Y&#213;&#216;           > E8 98 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{294} normal block at 0x000001D8D55986A0, 16 bytes long.
 Data: <&#192; Y&#213;&#216;           > C0 98 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{293} normal block at 0x000001D8D5594EB0, 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 0x000001D8D5599550, 16 bytes long.
 Data: <&#184;&#234;W&#213;&#216;           > B8 EA 57 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{291} normal block at 0x000001D8D55939C0, 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 0x000001D8D5599500, 16 bytes long.
 Data: < &#234;W&#213;&#216;           > 90 EA 57 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{288} normal block at 0x000001D8D5599190, 16 bytes long.
 Data: <h&#234;W&#213;&#216;           > 68 EA 57 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{287} normal block at 0x000001D8D5598D80, 16 bytes long.
 Data: <@&#234;W&#213;&#216;           > 40 EA 57 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{286} normal block at 0x000001D8D5599410, 16 bytes long.
 Data: < &#234;W&#213;&#216;           > 18 EA 57 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x000001D8D5598AB0, 16 bytes long.
 Data: <&#240;&#233;W&#213;&#216;           > F0 E9 57 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{284} normal block at 0x000001D8D5598D30, 16 bytes long.
 Data: <&#200;&#233;W&#213;&#216;           > C8 E9 57 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{283} normal block at 0x000001D8D5593F60, 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 0x000001D8D5598BA0, 16 bytes long.
 Data: <&#160;&#233;W&#213;&#216;           > A0 E9 57 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{281} normal block at 0x000001D8D557E9A0, 320 bytes long.
 Data: <&#160;&#139;Y&#213;&#216;   `?Y&#213;&#216;   > A0 8B 59 D5 D8 01 00 00 60 3F 59 D5 D8 01 00 00 
{280} normal block at 0x000001D8D5598B00, 16 bytes long.
 Data: <&#160; Y&#213;&#216;           > A0 98 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{279} normal block at 0x000001D8D5599460, 16 bytes long.
 Data: <x Y&#213;&#216;           > 78 98 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{278} normal block at 0x000001D8D55938A0, 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 0x000001D8D5598E20, 16 bytes long.
 Data: <P Y&#213;&#216;           > 50 98 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{276} normal block at 0x000001D8D55933C0, 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 0x000001D8D5598C90, 16 bytes long.
 Data: < &#151;Y&#213;&#216;           > 98 97 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{274} normal block at 0x000001D8D5598A60, 16 bytes long.
 Data: <p&#151;Y&#213;&#216;           > 70 97 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{273} normal block at 0x000001D8D5599320, 16 bytes long.
 Data: <H&#151;Y&#213;&#216;           > 48 97 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{272} normal block at 0x000001D8D55990A0, 16 bytes long.
 Data: < &#151;Y&#213;&#216;           > 20 97 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{271} normal block at 0x000001D8D55992D0, 16 bytes long.
 Data: <&#248;&#150;Y&#213;&#216;           > F8 96 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x000001D8D5598C40, 16 bytes long.
 Data: <&#208;&#150;Y&#213;&#216;           > D0 96 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x000001D8D5598830, 16 bytes long.
 Data: <pPY&#213;&#216;           > 70 50 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{267} normal block at 0x000001D8D5595070, 40 bytes long.
 Data: <0 Y&#213;&#216;   &#176;&#131;5&#215;&#216;   > 30 88 59 D5 D8 01 00 00 B0 83 35 D7 D8 01 00 00 
{266} normal block at 0x000001D8D5598EC0, 16 bytes long.
 Data: <&#176;&#150;Y&#213;&#216;           > B0 96 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{265} normal block at 0x000001D8D5598B50, 16 bytes long.
 Data: < &#150;Y&#213;&#216;           > 88 96 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{264} normal block at 0x000001D8D5593840, 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 0x000001D8D55990F0, 16 bytes long.
 Data: <`&#150;Y&#213;&#216;           > 60 96 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{262} normal block at 0x000001D8D5599660, 992 bytes long.
 Data: <&#240; Y&#213;&#216;   @8Y&#213;&#216;   > F0 90 59 D5 D8 01 00 00 40 38 59 D5 D8 01 00 00 
{98} normal block at 0x000001D8D5593AE0, 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 0x000001D8D558E2F0, 16 bytes long.
 Data: <@NY&#213;&#216;           > 40 4E 59 D5 D8 01 00 00 00 00 00 00 00 00 00 00 
{96} normal block at 0x000001D8D5594E40, 40 bytes long.
 Data: <&#240;&#226;X&#213;&#216;   &#224;:Y&#213;&#216;   > F0 E2 58 D5 D8 01 00 00 E0 3A 59 D5 D8 01 00 00 
{75} normal block at 0x000001D8D558DC10, 16 bytes long.
 Data: < &#234;vs&#247;           > 80 EA 76 73 F7 7F 00 00 00 00 00 00 00 00 00 00 
{74} normal block at 0x000001D8D558E250, 16 bytes long.
 Data: <@&#233;vs&#247;           > 40 E9 76 73 F7 7F 00 00 00 00 00 00 00 00 00 00 
{73} normal block at 0x000001D8D558E200, 16 bytes long.
 Data: <&#248;Wss&#247;           > F8 57 73 73 F7 7F 00 00 00 00 00 00 00 00 00 00 
{72} normal block at 0x000001D8D558E1B0, 16 bytes long.
 Data: <&#216;Wss&#247;           > D8 57 73 73 F7 7F 00 00 00 00 00 00 00 00 00 00 
{71} normal block at 0x000001D8D558E0C0, 16 bytes long.
 Data: <P ss&#247;           > 50 04 73 73 F7 7F 00 00 00 00 00 00 00 00 00 00 
{70} normal block at 0x000001D8D558DD00, 16 bytes long.
 Data: <0 ss&#247;           > 30 04 73 73 F7 7F 00 00 00 00 00 00 00 00 00 00 
{69} normal block at 0x000001D8D558E070, 16 bytes long.
 Data: <&#224; ss&#247;           > E0 02 73 73 F7 7F 00 00 00 00 00 00 00 00 00 00 
{68} normal block at 0x000001D8D558E3E0, 16 bytes long.
 Data: <  ss&#247;           > 10 04 73 73 F7 7F 00 00 00 00 00 00 00 00 00 00 
{67} normal block at 0x000001D8D558E020, 16 bytes long.
 Data: <p ss&#247;           > 70 04 73 73 F7 7F 00 00 00 00 00 00 00 00 00 00 
{66} normal block at 0x000001D8D558D710, 16 bytes long.
 Data: < &#192;qs&#247;           > 18 C0 71 73 F7 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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