Task 38610887

Name hif2a_A39_A31_r0_4-QUICO_ATM_GAFF2_NAGL_hif2a-5-6-RND8515_0
Workunit 31563706
Created 15 Apr 2026, 13:54:24 UTC
Sent 15 Apr 2026, 13:54:55 UTC
Report deadline 20 Apr 2026, 13:54:55 UTC
Received 16 Apr 2026, 5:16:44 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 652012
Run time 1 min 45 sec
CPU time 1 sec
Validate state Invalid
Credit 0.00
Device peak FLOPS 2,143.39 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 50.15 MB
Peak swap size 38.47 MB
Peak disk usage 1.54 GB

Stderr output

<core_client_version>8.0.2</core_client_version>
<![CDATA[
<message>
(unknown error) (0) - exit code 195 (0xc3)</message>
<stderr_txt>
12:13:10 (5020): wrapper (7.9.26016): starting
12:13:10 (5020): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A39_A31_0.pdb
QB_A39_A31_0.xml
QB_A39_A31.inpcrd
QB_A39_A31_input.yaml
QB_A39_A31.pdb
QB_A39_A31.prmtop
QB_A39_A31_sys.xml
run.bat
run.sh
12:13:12 (5020): Library/usr/bin/tar.exe exited; CPU time 0.000000
12:13:12 (5020): 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 0x00000233FC3A1B10>: 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 0x00000233FD7B84D0>: 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 0x00000233FD7B8D50>: 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 0x00000233FD7B9610>: 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 0x00000233FD7B9B50>: 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 0x000001ED2B320310>: 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 0x000001ED2B3220D0>: 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 0x000001ED2B322BD0>: 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 0x000001ED2B323790>: 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 0x000001ED2B3303D0>: 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 'D:\\BOINCDATA\\slots\\0\\Scripts\\rbfe_production.exe': [Errno 2] No such file or directory
12:14:05 (5020): C:/Windows/system32/cmd.exe exited; CPU time 1.531250
12:14:05 (5020): app exit status: 0x16
12:14:05 (5020): called boinc_finish(195)
0 bytes in 0 Free Blocks.
536 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: 631857 bytes.
Dumping objects ->
{3835306} normal block at 0x00000276062F6060, 48 bytes long.
 Data: <PATH=D:\BOINCDAT> 50 41 54 48 3D 44 3A 5C 42 4F 49 4E 43 44 41 54 
{3835295} normal block at 0x0000027607E23630, 32 bytes long.
 Data: <HOME=D:\BOINCDAT> 48 4F 4D 45 3D 44 3A 5C 42 4F 49 4E 43 44 41 54 
{3835284} normal block at 0x0000027607E248F0, 32 bytes long.
 Data: <TMP=D:\BOINCDATA> 54 4D 50 3D 44 3A 5C 42 4F 49 4E 43 44 41 54 41 
{3835273} normal block at 0x0000027607E24A70, 32 bytes long.
 Data: <TEMP=D:\BOINCDAT> 54 45 4D 50 3D 44 3A 5C 42 4F 49 4E 43 44 41 54 
{3835262} normal block at 0x0000027607E24650, 32 bytes long.
 Data: <TMPDIR=D:\BOINCD> 54 4D 50 44 49 52 3D 44 3A 5C 42 4F 49 4E 43 44 
{3835231} normal block at 0x00000276062F5AB0, 48 bytes long.
 Data: <PATH=D:\BOINCDAT> 50 41 54 48 3D 44 3A 5C 42 4F 49 4E 43 44 41 54 
{3835220} normal block at 0x0000027607E2C3D0, 180 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) : {3835217} normal block at 0x00000276062C6C90, 8 bytes long.
 Data: <  &#205; v   > 00 00 CD 07 76 02 00 00 
{3834576} normal block at 0x0000027607E2C2E0, 180 bytes long.
 Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65 
{3833947} normal block at 0x00000276062C6E20, 8 bytes long.
 Data: <`r&#210; v   > 60 72 D2 07 76 02 00 00 
..\zip\boinc_zip.cpp(122) : {305} normal block at 0x00000276062D14E0, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{290} normal block at 0x00000276062B5C30, 80 bytes long.
 Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C 
{289} normal block at 0x00000276062D2D40, 16 bytes long.
 Data: <&#216;5- v           > D8 35 2D 06 76 02 00 00 00 00 00 00 00 00 00 00 
{288} normal block at 0x00000276062D2930, 16 bytes long.
 Data: <&#176;5- v           > B0 35 2D 06 76 02 00 00 00 00 00 00 00 00 00 00 
{287} normal block at 0x00000276062CC9F0, 32 bytes long.
 Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D 
{286} normal block at 0x00000276062D2C00, 16 bytes long.
 Data: < 5- v           > 88 35 2D 06 76 02 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x00000276062D28E0, 16 bytes long.
 Data: <`5- v           > 60 35 2D 06 76 02 00 00 00 00 00 00 00 00 00 00 
{284} normal block at 0x00000276062D2840, 16 bytes long.
 Data: <85- v           > 38 35 2D 06 76 02 00 00 00 00 00 00 00 00 00 00 
{283} normal block at 0x00000276062D22F0, 16 bytes long.
 Data: < 5- v           > 10 35 2D 06 76 02 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x00000276062CB0F0, 48 bytes long.
 Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F 
{281} normal block at 0x00000276062D23E0, 16 bytes long.
 Data: <&#200;[+ v           > C8 5B 2B 06 76 02 00 00 00 00 00 00 00 00 00 00 
{280} normal block at 0x00000276062CC810, 32 bytes long.
 Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69 
{279} normal block at 0x00000276062D27F0, 16 bytes long.
 Data: <&#160;[+ v           > A0 5B 2B 06 76 02 00 00 00 00 00 00 00 00 00 00 
{277} normal block at 0x00000276062D2BB0, 16 bytes long.
 Data: <x[+ v           > 78 5B 2B 06 76 02 00 00 00 00 00 00 00 00 00 00 
{276} normal block at 0x00000276062D27A0, 16 bytes long.
 Data: <P[+ v           > 50 5B 2B 06 76 02 00 00 00 00 00 00 00 00 00 00 
{275} normal block at 0x00000276062D2750, 16 bytes long.
 Data: <([+ v           > 28 5B 2B 06 76 02 00 00 00 00 00 00 00 00 00 00 
{274} normal block at 0x00000276062D2A20, 16 bytes long.
 Data: < [+ v           > 00 5B 2B 06 76 02 00 00 00 00 00 00 00 00 00 00 
{273} normal block at 0x00000276062D2430, 16 bytes long.
 Data: <&#216;Z+ v           > D8 5A 2B 06 76 02 00 00 00 00 00 00 00 00 00 00 
{272} normal block at 0x00000276062CD230, 32 bytes long.
 Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55 
{271} normal block at 0x00000276062D2700, 16 bytes long.
 Data: <&#176;Z+ v           > B0 5A 2B 06 76 02 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x00000276062B5AB0, 320 bytes long.
 Data: < '- v   0&#210;, v   > 00 27 2D 06 76 02 00 00 30 D2 2C 06 76 02 00 00 
{269} normal block at 0x00000276062D30B0, 16 bytes long.
 Data: <&#240;4- v           > F0 34 2D 06 76 02 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x00000276062D26B0, 16 bytes long.
 Data: <&#200;4- v           > C8 34 2D 06 76 02 00 00 00 00 00 00 00 00 00 00 
{267} normal block at 0x00000276062CCC90, 32 bytes long.
 Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65 
{266} normal block at 0x00000276062D3010, 16 bytes long.
 Data: <&#160;4- v           > A0 34 2D 06 76 02 00 00 00 00 00 00 00 00 00 00 
{265} normal block at 0x00000276062CCDB0, 32 bytes long.
 Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62 
{264} normal block at 0x00000276062D2660, 16 bytes long.
 Data: <&#232;3- v           > E8 33 2D 06 76 02 00 00 00 00 00 00 00 00 00 00 
{263} normal block at 0x00000276062D2B60, 16 bytes long.
 Data: <&#192;3- v           > C0 33 2D 06 76 02 00 00 00 00 00 00 00 00 00 00 
{262} normal block at 0x00000276062D2B10, 16 bytes long.
 Data: < 3- v           > 98 33 2D 06 76 02 00 00 00 00 00 00 00 00 00 00 
{261} normal block at 0x00000276062D2520, 16 bytes long.
 Data: <p3- v           > 70 33 2D 06 76 02 00 00 00 00 00 00 00 00 00 00 
{260} normal block at 0x00000276062D2480, 16 bytes long.
 Data: <H3- v           > 48 33 2D 06 76 02 00 00 00 00 00 00 00 00 00 00 
{259} normal block at 0x00000276062D2890, 16 bytes long.
 Data: < 3- v           > 20 33 2D 06 76 02 00 00 00 00 00 00 00 00 00 00 
{257} normal block at 0x00000276062D2CF0, 16 bytes long.
 Data: <`&#177;, v           > 60 B1 2C 06 76 02 00 00 00 00 00 00 00 00 00 00 
{256} normal block at 0x00000276062CB160, 40 bytes long.
 Data: <&#240;,- v   &#176;Z/ v   > F0 2C 2D 06 76 02 00 00 B0 5A 2F 06 76 02 00 00 
{255} normal block at 0x00000276062D2F20, 16 bytes long.
 Data: < 3- v           > 00 33 2D 06 76 02 00 00 00 00 00 00 00 00 00 00 
{254} normal block at 0x00000276062D2610, 16 bytes long.
 Data: <&#216;2- v           > D8 32 2D 06 76 02 00 00 00 00 00 00 00 00 00 00 
{253} normal block at 0x00000276062CCFF0, 32 bytes long.
 Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F 
{252} normal block at 0x00000276062D24D0, 16 bytes long.
 Data: <&#176;2- v           > B0 32 2D 06 76 02 00 00 00 00 00 00 00 00 00 00 
{251} normal block at 0x00000276062D32B0, 992 bytes long.
 Data: <&#208;$- v   &#240;&#207;, v   > D0 24 2D 06 76 02 00 00 F0 CF 2C 06 76 02 00 00 
{87} normal block at 0x00000276062CC930, 32 bytes long.
 Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F 
{86} normal block at 0x00000276062C71E0, 16 bytes long.
 Data: <&#240;&#183;, v           > F0 B7 2C 06 76 02 00 00 00 00 00 00 00 00 00 00 
{85} normal block at 0x00000276062CB7F0, 40 bytes long.
 Data: <&#224;q, v   0&#201;, v   > E0 71 2C 06 76 02 00 00 30 C9 2C 06 76 02 00 00 
{64} normal block at 0x00000276062C64C0, 16 bytes long.
 Data: < &#234;&#208;&#250;&#246;           > 80 EA D0 FA F6 7F 00 00 00 00 00 00 00 00 00 00 
{63} normal block at 0x00000276062C6880, 16 bytes long.
 Data: <@&#233;&#208;&#250;&#246;           > 40 E9 D0 FA F6 7F 00 00 00 00 00 00 00 00 00 00 
{62} normal block at 0x00000276062C6EC0, 16 bytes long.
 Data: <&#248;W&#205;&#250;&#246;           > F8 57 CD FA F6 7F 00 00 00 00 00 00 00 00 00 00 
{61} normal block at 0x00000276062C6C40, 16 bytes long.
 Data: <&#216;W&#205;&#250;&#246;           > D8 57 CD FA F6 7F 00 00 00 00 00 00 00 00 00 00 
{60} normal block at 0x00000276062C7050, 16 bytes long.
 Data: <P &#205;&#250;&#246;           > 50 04 CD FA F6 7F 00 00 00 00 00 00 00 00 00 00 
{59} normal block at 0x00000276062C7190, 16 bytes long.
 Data: <0 &#205;&#250;&#246;           > 30 04 CD FA F6 7F 00 00 00 00 00 00 00 00 00 00 
{58} normal block at 0x00000276062C6BF0, 16 bytes long.
 Data: <&#224; &#205;&#250;&#246;           > E0 02 CD FA F6 7F 00 00 00 00 00 00 00 00 00 00 
{57} normal block at 0x00000276062C6A10, 16 bytes long.
 Data: <  &#205;&#250;&#246;           > 10 04 CD FA F6 7F 00 00 00 00 00 00 00 00 00 00 
{56} normal block at 0x00000276062C7140, 16 bytes long.
 Data: <p &#205;&#250;&#246;           > 70 04 CD FA F6 7F 00 00 00 00 00 00 00 00 00 00 
{55} normal block at 0x00000276062C6A60, 16 bytes long.
 Data: < &#192;&#203;&#250;&#246;           > 18 C0 CB FA F6 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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