Task 38615874

Name p38_2_A27_A17_r0_2-QUICO_ATM_OpenFF_NAGL_p38_2-0-6-RND5791_1
Workunit 31567868
Created 17 Apr 2026, 17:41:15 UTC
Sent 17 Apr 2026, 17:45:11 UTC
Report deadline 22 Apr 2026, 17:45:11 UTC
Received 17 Apr 2026, 17:48:19 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 124372
Run time 1 min 6 sec
CPU time 1 sec
Validate state Invalid
Credit 0.00
Device peak FLOPS 22,727.24 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 51.72 MB
Peak swap size 36.56 MB
Peak disk usage 1.42 GB

Stderr output

<core_client_version>8.2.9</core_client_version>
<![CDATA[
<message>
El sistema operativo no puede ejecutar (null).
 (0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
19:45:57 (9976): wrapper (7.9.26016): starting
19:45:57 (9976): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A27_A17_0.pdb
QB_A27_A17_0.xml
QB_A27_A17.inpcrd
QB_A27_A17_input.yaml
QB_A27_A17.pdb
QB_A27_A17.prmtop
QB_A27_A17_sys.xml
run.bat
run.sh
19:45:58 (9976): Library/usr/bin/tar.exe exited; CPU time 0.000000
19:45:58 (9976): 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 0x000001C1C940FD10>: Failed to establish a new connection: [WinError 10013] Intento de acceso a un socket no permitido por sus permisos de acceso')': /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 0x000001C1C9418950>: Failed to establish a new connection: [WinError 10013] Intento de acceso a un socket no permitido por sus permisos de acceso')': /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 0x000001C1C9418F90>: Failed to establish a new connection: [WinError 10013] Intento de acceso a un socket no permitido por sus permisos de acceso')': /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 0x000001C1C9419910>: Failed to establish a new connection: [WinError 10013] Intento de acceso a un socket no permitido por sus permisos de acceso')': /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 0x000001C1C941A390>: Failed to establish a new connection: [WinError 10013] Intento de acceso a un socket no permitido por sus permisos de acceso')': /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 0x0000027EB8C1FE90>: Failed to establish a new connection: [WinError 10013] Intento de acceso a un socket no permitido por sus permisos de acceso')': /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 0x0000027EB8D66110>: Failed to establish a new connection: [WinError 10013] Intento de acceso a un socket no permitido por sus permisos de acceso')': /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 0x0000027EB8D66D10>: Failed to establish a new connection: [WinError 10013] Intento de acceso a un socket no permitido por sus permisos de acceso')': /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 0x0000027EB8D67990>: Failed to establish a new connection: [WinError 10013] Intento de acceso a un socket no permitido por sus permisos de acceso')': /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 0x0000027EB8D74290>: Failed to establish a new connection: [WinError 10013] Intento de acceso a un socket no permitido por sus permisos de acceso')': /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 'F:\\BOINC\\data\\slots\\2\\Scripts\\rbfe_production.exe': [Errno 2] No such file or directory
19:46:21 (9976): C:/Windows/system32/cmd.exe exited; CPU time 1.390625
19:46:21 (9976): app exit status: 0x16
19:46:21 (9976): called boinc_finish(195)
0 bytes in 0 Free Blocks.
456 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: 426585 bytes.
Dumping objects ->
{3835555} normal block at 0x00000299AF3F5650, 48 bytes long.
 Data: <PATH=F:\BOINC\da> 50 41 54 48 3D 46 3A 5C 42 4F 49 4E 43 5C 64 61 
{3835544} normal block at 0x00000299B1140AE0, 32 bytes long.
 Data: <HOME=F:\BOINC\da> 48 4F 4D 45 3D 46 3A 5C 42 4F 49 4E 43 5C 64 61 
{3835533} normal block at 0x00000299B1140A80, 32 bytes long.
 Data: <TMP=F:\BOINC\dat> 54 4D 50 3D 46 3A 5C 42 4F 49 4E 43 5C 64 61 74 
{3835522} normal block at 0x00000299B11418C0, 32 bytes long.
 Data: <TEMP=F:\BOINC\da> 54 45 4D 50 3D 46 3A 5C 42 4F 49 4E 43 5C 64 61 
{3835511} normal block at 0x00000299B1141680, 32 bytes long.
 Data: <TMPDIR=F:\BOINC\> 54 4D 50 44 49 52 3D 46 3A 5C 42 4F 49 4E 43 5C 
{3835480} normal block at 0x00000299AF3F5810, 48 bytes long.
 Data: <PATH=F:\BOINC\da> 50 41 54 48 3D 46 3A 5C 42 4F 49 4E 43 5C 64 61 
{3835469} normal block at 0x00000299AF44D460, 140 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) : {3835466} normal block at 0x00000299AF3EB2D0, 8 bytes long.
 Data: <  &#131;&#175;    > 00 00 83 AF 99 02 00 00 
{3834691} normal block at 0x00000299AF44D870, 140 bytes long.
 Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65 
{3833963} normal block at 0x00000299AF3EB000, 8 bytes long.
 Data: <`&#221;=&#175;    > 60 DD 3D AF 99 02 00 00 
..\zip\boinc_zip.cpp(122) : {313} normal block at 0x00000299AF3E1A10, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{298} normal block at 0x00000299AF3E2B40, 80 bytes long.
 Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C 
{297} normal block at 0x00000299AF3F64F0, 16 bytes long.
 Data: <ht?&#175;            > 68 74 3F AF 99 02 00 00 00 00 00 00 00 00 00 00 
{296} normal block at 0x00000299AF3F63B0, 16 bytes long.
 Data: <@t?&#175;            > 40 74 3F AF 99 02 00 00 00 00 00 00 00 00 00 00 
{295} normal block at 0x00000299AF3F0250, 32 bytes long.
 Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D 
{294} normal block at 0x00000299AF3F69A0, 16 bytes long.
 Data: < t?&#175;            > 18 74 3F AF 99 02 00 00 00 00 00 00 00 00 00 00 
{293} normal block at 0x00000299AF3F6770, 16 bytes long.
 Data: <&#240;s?&#175;            > F0 73 3F AF 99 02 00 00 00 00 00 00 00 00 00 00 
{292} normal block at 0x00000299AF3F6680, 16 bytes long.
 Data: <&#200;s?&#175;            > C8 73 3F AF 99 02 00 00 00 00 00 00 00 00 00 00 
{291} normal block at 0x00000299AF3F6220, 16 bytes long.
 Data: <&#160;s?&#175;            > A0 73 3F AF 99 02 00 00 00 00 00 00 00 00 00 00 
{290} normal block at 0x00000299AF3F5C70, 48 bytes long.
 Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F 
{289} normal block at 0x00000299AF3F6720, 16 bytes long.
 Data: <  >&#175;            > 98 0D 3E AF 99 02 00 00 00 00 00 00 00 00 00 00 
{288} normal block at 0x00000299AF3F0D90, 32 bytes long.
 Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69 
{287} normal block at 0x00000299AF3F7080, 16 bytes long.
 Data: <p >&#175;            > 70 0D 3E AF 99 02 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x00000299AF3F6BD0, 16 bytes long.
 Data: <H >&#175;            > 48 0D 3E AF 99 02 00 00 00 00 00 00 00 00 00 00 
{284} normal block at 0x00000299AF3F6A40, 16 bytes long.
 Data: <  >&#175;            > 20 0D 3E AF 99 02 00 00 00 00 00 00 00 00 00 00 
{283} normal block at 0x00000299AF3F6400, 16 bytes long.
 Data: <&#248; >&#175;            > F8 0C 3E AF 99 02 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x00000299AF3F6CC0, 16 bytes long.
 Data: <&#208; >&#175;            > D0 0C 3E AF 99 02 00 00 00 00 00 00 00 00 00 00 
{281} normal block at 0x00000299AF3F6310, 16 bytes long.
 Data: <&#168; >&#175;            > A8 0C 3E AF 99 02 00 00 00 00 00 00 00 00 00 00 
{280} normal block at 0x00000299AF3F06D0, 32 bytes long.
 Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55 
{279} normal block at 0x00000299AF3F61D0, 16 bytes long.
 Data: <  >&#175;            > 80 0C 3E AF 99 02 00 00 00 00 00 00 00 00 00 00 
{278} normal block at 0x00000299AF3E0C80, 320 bytes long.
 Data: <&#208;a?&#175;    &#208; ?&#175;    > D0 61 3F AF 99 02 00 00 D0 06 3F AF 99 02 00 00 
{277} normal block at 0x00000299AF3F67C0, 16 bytes long.
 Data: < s?&#175;            > 80 73 3F AF 99 02 00 00 00 00 00 00 00 00 00 00 
{276} normal block at 0x00000299AF3F69F0, 16 bytes long.
 Data: <Xs?&#175;            > 58 73 3F AF 99 02 00 00 00 00 00 00 00 00 00 00 
{275} normal block at 0x00000299AF3F03D0, 32 bytes long.
 Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65 
{274} normal block at 0x00000299AF3F6860, 16 bytes long.
 Data: <0s?&#175;            > 30 73 3F AF 99 02 00 00 00 00 00 00 00 00 00 00 
{273} normal block at 0x00000299AF3F0970, 32 bytes long.
 Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62 
{272} normal block at 0x00000299AF3F6B30, 16 bytes long.
 Data: <xr?&#175;            > 78 72 3F AF 99 02 00 00 00 00 00 00 00 00 00 00 
{271} normal block at 0x00000299AF3F62C0, 16 bytes long.
 Data: <Pr?&#175;            > 50 72 3F AF 99 02 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x00000299AF3F6630, 16 bytes long.
 Data: <(r?&#175;            > 28 72 3F AF 99 02 00 00 00 00 00 00 00 00 00 00 
{269} normal block at 0x00000299AF3F65E0, 16 bytes long.
 Data: < r?&#175;            > 00 72 3F AF 99 02 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x00000299AF3F6950, 16 bytes long.
 Data: <&#216;q?&#175;            > D8 71 3F AF 99 02 00 00 00 00 00 00 00 00 00 00 
{267} normal block at 0x00000299AF3F6C20, 16 bytes long.
 Data: <&#176;q?&#175;            > B0 71 3F AF 99 02 00 00 00 00 00 00 00 00 00 00 
{265} normal block at 0x00000299AF3F6270, 16 bytes long.
 Data: < [?&#175;            > 90 5B 3F AF 99 02 00 00 00 00 00 00 00 00 00 00 
{264} normal block at 0x00000299AF3F5B90, 40 bytes long.
 Data: <pb?&#175;     X?&#175;    > 70 62 3F AF 99 02 00 00 10 58 3F AF 99 02 00 00 
{263} normal block at 0x00000299AF3F6180, 16 bytes long.
 Data: < q?&#175;            > 90 71 3F AF 99 02 00 00 00 00 00 00 00 00 00 00 
{262} normal block at 0x00000299AF3F6EF0, 16 bytes long.
 Data: <hq?&#175;            > 68 71 3F AF 99 02 00 00 00 00 00 00 00 00 00 00 
{261} normal block at 0x00000299AF3F0FD0, 32 bytes long.
 Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F 
{260} normal block at 0x00000299AF3F6360, 16 bytes long.
 Data: <@q?&#175;            > 40 71 3F AF 99 02 00 00 00 00 00 00 00 00 00 00 
{259} normal block at 0x00000299AF3F7140, 992 bytes long.
 Data: <`c?&#175;    &#208; ?&#175;    > 60 63 3F AF 99 02 00 00 D0 0F 3F AF 99 02 00 00 
{95} normal block at 0x00000299AF3F0670, 32 bytes long.
 Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F 
{94} normal block at 0x00000299AF3EB6E0, 16 bytes long.
 Data: < &#199;=&#175;            > 00 C7 3D AF 99 02 00 00 00 00 00 00 00 00 00 00 
{93} normal block at 0x00000299AF3DC700, 40 bytes long.
 Data: <&#224;&#182;>&#175;    p ?&#175;    > E0 B6 3E AF 99 02 00 00 70 06 3F AF 99 02 00 00 
{72} normal block at 0x00000299AF3EB730, 16 bytes long.
 Data: < &#234;  &#246;           > 80 EA 05 0A F6 7F 00 00 00 00 00 00 00 00 00 00 
{71} normal block at 0x00000299AF3EB5A0, 16 bytes long.
 Data: <@&#233;  &#246;           > 40 E9 05 0A F6 7F 00 00 00 00 00 00 00 00 00 00 
{70} normal block at 0x00000299AF3EBB90, 16 bytes long.
 Data: <&#248;W  &#246;           > F8 57 02 0A F6 7F 00 00 00 00 00 00 00 00 00 00 
{69} normal block at 0x00000299AF3EB550, 16 bytes long.
 Data: <&#216;W  &#246;           > D8 57 02 0A F6 7F 00 00 00 00 00 00 00 00 00 00 
{68} normal block at 0x00000299AF3EB370, 16 bytes long.
 Data: <P   &#246;           > 50 04 02 0A F6 7F 00 00 00 00 00 00 00 00 00 00 
{67} normal block at 0x00000299AF3EB320, 16 bytes long.
 Data: <0   &#246;           > 30 04 02 0A F6 7F 00 00 00 00 00 00 00 00 00 00 
{66} normal block at 0x00000299AF3EB8C0, 16 bytes long.
 Data: <&#224;   &#246;           > E0 02 02 0A F6 7F 00 00 00 00 00 00 00 00 00 00 
{65} normal block at 0x00000299AF3EB280, 16 bytes long.
 Data: <    &#246;           > 10 04 02 0A F6 7F 00 00 00 00 00 00 00 00 00 00 
{64} normal block at 0x00000299AF3EB500, 16 bytes long.
 Data: <p   &#246;           > 70 04 02 0A F6 7F 00 00 00 00 00 00 00 00 00 00 
{63} normal block at 0x00000299AF3EBC30, 16 bytes long.
 Data: < &#192;  &#246;           > 18 C0 00 0A F6 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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