Task 38608906

Name tnks2_A02_A20_r0_5-QUICO_ATM_GAFF2_NAGL_TNKS2-4-6-RND6915_1
Workunit 31562017
Created 14 Apr 2026, 19:25:49 UTC
Sent 14 Apr 2026, 19:26:09 UTC
Report deadline 19 Apr 2026, 19:26:09 UTC
Received 14 Apr 2026, 19:29:22 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 8 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 51.34 MB
Peak swap size 37.16 MB
Peak disk usage 1.55 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>
21:27:02 (22736): wrapper (7.9.26016): starting
21:27:02 (22736): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A02_A20_0.pdb
QB_A02_A20_0.xml
QB_A02_A20.inpcrd
QB_A02_A20_input.yaml
QB_A02_A20.pdb
QB_A02_A20.prmtop
QB_A02_A20_sys.xml
run.bat
run.sh
21:27:03 (22736): Library/usr/bin/tar.exe exited; CPU time 0.000000
21:27:03 (22736): 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 0x000001C66065FC90>: 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 0x000001C660668950>: 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 0x000001C660668F90>: 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 0x000001C660669910>: 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 0x000001C66066A390>: 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 0x000002D62F235410>: 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 0x000002D62F236290>: 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 0x000002D62F236ED0>: 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 0x000002D62F237B50>: 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 0x000002D62F244450>: 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
21:27:29 (22736): C:/Windows/system32/cmd.exe exited; CPU time 1.328125
21:27:29 (22736): app exit status: 0x16
21:27:29 (22736): 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: 489567 bytes.
Dumping objects ->
{3835555} normal block at 0x0000016019B7F460, 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 0x0000016019C13F20, 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 0x0000016019C13B00, 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 0x0000016019C13740, 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 0x0000016019C13D40, 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 0x0000016017E55C50, 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 0x0000016019A5CAC0, 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 0x0000016017E4CA50, 8 bytes long.
 Data: <  2 `   > 00 00 32 18 60 01 00 00 
{3834691} normal block at 0x0000016019A5D6F0, 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 0x0000016017E4BF60, 8 bytes long.
 Data: <P&#221;&#227; `   > 50 DD E3 17 60 01 00 00 
..\zip\boinc_zip.cpp(122) : {313} normal block at 0x0000016017E41640, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{298} normal block at 0x0000016017E427D0, 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 0x0000016017E57660, 16 bytes long.
 Data: <&#232;&#132;&#229; `           > E8 84 E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{296} normal block at 0x0000016017E57980, 16 bytes long.
 Data: <&#192;&#132;&#229; `           > C0 84 E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{295} normal block at 0x0000016017E51190, 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 0x0000016017E57A20, 16 bytes long.
 Data: < &#132;&#229; `           > 98 84 E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{293} normal block at 0x0000016017E57890, 16 bytes long.
 Data: <p&#132;&#229; `           > 70 84 E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{292} normal block at 0x0000016017E580B0, 16 bytes long.
 Data: <H&#132;&#229; `           > 48 84 E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{291} normal block at 0x0000016017E57B10, 16 bytes long.
 Data: < &#132;&#229; `           > 20 84 E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{290} normal block at 0x0000016017E56040, 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 0x0000016017E57BB0, 16 bytes long.
 Data: <  &#228; `           > 88 0D E4 17 60 01 00 00 00 00 00 00 00 00 00 00 
{288} normal block at 0x0000016017E51C70, 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 0x0000016017E57C50, 16 bytes long.
 Data: <` &#228; `           > 60 0D E4 17 60 01 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x0000016017E57B60, 16 bytes long.
 Data: <8 &#228; `           > 38 0D E4 17 60 01 00 00 00 00 00 00 00 00 00 00 
{284} normal block at 0x0000016017E57ED0, 16 bytes long.
 Data: <  &#228; `           > 10 0D E4 17 60 01 00 00 00 00 00 00 00 00 00 00 
{283} normal block at 0x0000016017E57570, 16 bytes long.
 Data: <&#232; &#228; `           > E8 0C E4 17 60 01 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x0000016017E58010, 16 bytes long.
 Data: <&#192; &#228; `           > C0 0C E4 17 60 01 00 00 00 00 00 00 00 00 00 00 
{281} normal block at 0x0000016017E57200, 16 bytes long.
 Data: <  &#228; `           > 98 0C E4 17 60 01 00 00 00 00 00 00 00 00 00 00 
{280} normal block at 0x0000016017E51D90, 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 0x0000016017E57E30, 16 bytes long.
 Data: <p &#228; `           > 70 0C E4 17 60 01 00 00 00 00 00 00 00 00 00 00 
{278} normal block at 0x0000016017E40C70, 320 bytes long.
 Data: <0~&#229; `     &#229; `   > 30 7E E5 17 60 01 00 00 90 1D E5 17 60 01 00 00 
{277} normal block at 0x0000016017E57E80, 16 bytes long.
 Data: < &#132;&#229; `           > 00 84 E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{276} normal block at 0x0000016017E57C00, 16 bytes long.
 Data: <&#216;&#131;&#229; `           > D8 83 E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{275} normal block at 0x0000016017E51550, 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 0x0000016017E57520, 16 bytes long.
 Data: <&#176;&#131;&#229; `           > B0 83 E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{273} normal block at 0x0000016017E514F0, 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 0x0000016017E57D40, 16 bytes long.
 Data: <&#248;&#130;&#229; `           > F8 82 E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{271} normal block at 0x0000016017E578E0, 16 bytes long.
 Data: <&#208;&#130;&#229; `           > D0 82 E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x0000016017E57480, 16 bytes long.
 Data: <&#168;&#130;&#229; `           > A8 82 E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{269} normal block at 0x0000016017E57AC0, 16 bytes long.
 Data: < &#130;&#229; `           > 80 82 E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x0000016017E57340, 16 bytes long.
 Data: <X&#130;&#229; `           > 58 82 E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{267} normal block at 0x0000016017E57CA0, 16 bytes long.
 Data: <0&#130;&#229; `           > 30 82 E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{265} normal block at 0x0000016017E574D0, 16 bytes long.
 Data: <&#176;`&#229; `           > B0 60 E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{264} normal block at 0x0000016017E560B0, 40 bytes long.
 Data: <&#208;t&#229; `   P\&#229; `   > D0 74 E5 17 60 01 00 00 50 5C E5 17 60 01 00 00 
{263} normal block at 0x0000016017E57930, 16 bytes long.
 Data: < &#130;&#229; `           > 10 82 E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{262} normal block at 0x0000016017E577F0, 16 bytes long.
 Data: <&#232; &#229; `           > E8 81 E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{261} normal block at 0x0000016017E51790, 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 0x0000016017E57750, 16 bytes long.
 Data: <&#192; &#229; `           > C0 81 E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{259} normal block at 0x0000016017E581C0, 992 bytes long.
 Data: <Pw&#229; `     &#229; `   > 50 77 E5 17 60 01 00 00 90 17 E5 17 60 01 00 00 
{95} normal block at 0x0000016017E51610, 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 0x0000016017E4CA00, 16 bytes long.
 Data: <&#160;]&#229; `           > A0 5D E5 17 60 01 00 00 00 00 00 00 00 00 00 00 
{93} normal block at 0x0000016017E55DA0, 40 bytes long.
 Data: < &#202;&#228; `     &#229; `   > 00 CA E4 17 60 01 00 00 10 16 E5 17 60 01 00 00 
{72} normal block at 0x0000016017E4C370, 16 bytes long.
 Data: < &#234;&#237; &#246;           > 80 EA ED 90 F6 7F 00 00 00 00 00 00 00 00 00 00 
{71} normal block at 0x0000016017E4C3C0, 16 bytes long.
 Data: <@&#233;&#237; &#246;           > 40 E9 ED 90 F6 7F 00 00 00 00 00 00 00 00 00 00 
{70} normal block at 0x0000016017E4C5A0, 16 bytes long.
 Data: <&#248;W&#234; &#246;           > F8 57 EA 90 F6 7F 00 00 00 00 00 00 00 00 00 00 
{69} normal block at 0x0000016017E4C0F0, 16 bytes long.
 Data: <&#216;W&#234; &#246;           > D8 57 EA 90 F6 7F 00 00 00 00 00 00 00 00 00 00 
{68} normal block at 0x0000016017E4C2D0, 16 bytes long.
 Data: <P &#234; &#246;           > 50 04 EA 90 F6 7F 00 00 00 00 00 00 00 00 00 00 
{67} normal block at 0x0000016017E4BD30, 16 bytes long.
 Data: <0 &#234; &#246;           > 30 04 EA 90 F6 7F 00 00 00 00 00 00 00 00 00 00 
{66} normal block at 0x0000016017E4CAA0, 16 bytes long.
 Data: <&#224; &#234; &#246;           > E0 02 EA 90 F6 7F 00 00 00 00 00 00 00 00 00 00 
{65} normal block at 0x0000016017E4BC90, 16 bytes long.
 Data: <  &#234; &#246;           > 10 04 EA 90 F6 7F 00 00 00 00 00 00 00 00 00 00 
{64} normal block at 0x0000016017E4C500, 16 bytes long.
 Data: <p &#234; &#246;           > 70 04 EA 90 F6 7F 00 00 00 00 00 00 00 00 00 00 
{63} normal block at 0x0000016017E4C7D0, 16 bytes long.
 Data: < &#192;&#232; &#246;           > 18 C0 E8 90 F6 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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