Task 38615410

Name p38_2_A18_A08_r0_3-QUICO_ATM_GAFF2_NAGL_p38_2-0-6-RND0618_0
Workunit 31567711
Created 17 Apr 2026, 16:49:43 UTC
Sent 17 Apr 2026, 17:09:46 UTC
Report deadline 22 Apr 2026, 17:09:46 UTC
Received 18 Apr 2026, 14:14:58 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 643553
Run time 5 min 17 sec
CPU time 2 sec
Validate state Invalid
Credit 0.00
Device peak FLOPS 3,041.19 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 46.94 MB
Peak swap size 35.48 MB
Peak disk usage 4.74 GB

Stderr output

<core_client_version>8.2.8</core_client_version>
<![CDATA[
<message>
The operating system cannot run (null).
 (0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
12:12:53 (9116): wrapper (7.9.26016): starting
12:12:53 (9116): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A18_A08_0.pdb
QB_A18_A08_0.xml
QB_A18_A08.inpcrd
QB_A18_A08_input.yaml
QB_A18_A08.pdb
QB_A18_A08.prmtop
QB_A18_A08_sys.xml
run.bat
run.sh
12:12:57 (9116): Library/usr/bin/tar.exe exited; CPU time 0.000000
12:12:57 (9116): 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 0x0000027A07EABC90>: 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 0x0000027A07EB4950>: 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 0x0000027A07EB4E90>: 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 0x0000027A07EB5850>: 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 0x0000027A07EB61D0>: 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 0x0000027BB4E018D0>: 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 0x0000027BB4E026D0>: 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 0x0000027BB4E02FD0>: 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 0x0000027BB4E03B50>: 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 0x0000027BB4E187D0>: 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\\0\\Scripts\\rbfe_production.exe': [Errno 2] No such file or directory
12:13:26 (9116): C:/Windows/system32/cmd.exe exited; CPU time 2.734375
12:13:26 (9116): app exit status: 0x16
12:13:26 (9116): 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: 305311 bytes.
Dumping objects ->
{3835177} normal block at 0x0000022EE567E510, 48 bytes long.
 Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835166} normal block at 0x0000022EE567E4A0, 48 bytes long.
 Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835155} normal block at 0x0000022EE567E350, 48 bytes long.
 Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61 
{3835144} normal block at 0x0000022EE567E2E0, 48 bytes long.
 Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835133} normal block at 0x0000022EE567E200, 48 bytes long.
 Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61 
{3835102} normal block at 0x0000022EE7199460, 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) : {3835088} normal block at 0x0000022EE5678E90, 8 bytes long.
 Data: <  e&#229;.   > 00 00 65 E5 2E 02 00 00 
{3833947} normal block at 0x0000022EE5679570, 8 bytes long.
 Data: < &#248;&&#231;.   > 10 F8 26 E7 2E 02 00 00 
..\zip\boinc_zip.cpp(122) : {305} normal block at 0x0000022EE567AF50, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{290} normal block at 0x0000022EE5678900, 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 0x0000022EE567F7C0, 16 bytes long.
 Data: <H&#234;g&#229;.           > 48 EA 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{288} normal block at 0x0000022EE567F360, 16 bytes long.
 Data: < &#234;g&#229;.           > 20 EA 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{287} normal block at 0x0000022EE5679A40, 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 0x0000022EE567F630, 16 bytes long.
 Data: <&#248;&#233;g&#229;.           > F8 E9 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x0000022EE567F5E0, 16 bytes long.
 Data: <&#208;&#233;g&#229;.           > D0 E9 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{284} normal block at 0x0000022EE567EE60, 16 bytes long.
 Data: <&#168;&#233;g&#229;.           > A8 E9 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{283} normal block at 0x0000022EE567EDC0, 16 bytes long.
 Data: < &#233;g&#229;.           > 80 E9 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x0000022EE567E5F0, 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 0x0000022EE567F860, 16 bytes long.
 Data: <  g&#229;.           > 98 88 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{280} normal block at 0x0000022EE5679CE0, 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 0x0000022EE567EF50, 16 bytes long.
 Data: <p g&#229;.           > 70 88 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{277} normal block at 0x0000022EE567F770, 16 bytes long.
 Data: <H g&#229;.           > 48 88 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{276} normal block at 0x0000022EE567ED20, 16 bytes long.
 Data: <  g&#229;.           > 20 88 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{275} normal block at 0x0000022EE567F270, 16 bytes long.
 Data: <&#248;&#135;g&#229;.           > F8 87 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{274} normal block at 0x0000022EE567F590, 16 bytes long.
 Data: <&#208;&#135;g&#229;.           > D0 87 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{273} normal block at 0x0000022EE567F400, 16 bytes long.
 Data: <&#168;&#135;g&#229;.           > A8 87 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{272} normal block at 0x0000022EE5679AA0, 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 0x0000022EE567F4F0, 16 bytes long.
 Data: < &#135;g&#229;.           > 80 87 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x0000022EE5678780, 320 bytes long.
 Data: <&#240;&#244;g&#229;.   &#160;&#154;g&#229;.   > F0 F4 67 E5 2E 02 00 00 A0 9A 67 E5 2E 02 00 00 
{269} normal block at 0x0000022EE567F3B0, 16 bytes long.
 Data: <`&#233;g&#229;.           > 60 E9 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x0000022EE567F450, 16 bytes long.
 Data: <8&#233;g&#229;.           > 38 E9 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{267} normal block at 0x0000022EE567A5E0, 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 0x0000022EE567F540, 16 bytes long.
 Data: < &#233;g&#229;.           > 10 E9 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{265} normal block at 0x0000022EE567A1C0, 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 0x0000022EE567ECD0, 16 bytes long.
 Data: <X&#232;g&#229;.           > 58 E8 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{263} normal block at 0x0000022EE567EE10, 16 bytes long.
 Data: <0&#232;g&#229;.           > 30 E8 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{262} normal block at 0x0000022EE567EF00, 16 bytes long.
 Data: < &#232;g&#229;.           > 08 E8 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{261} normal block at 0x0000022EE5678AD0, 16 bytes long.
 Data: <&#224;&#231;g&#229;.           > E0 E7 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{260} normal block at 0x0000022EE5678A80, 16 bytes long.
 Data: <&#184;&#231;g&#229;.           > B8 E7 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{259} normal block at 0x0000022EE5679930, 16 bytes long.
 Data: < &#231;g&#229;.           > 90 E7 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{257} normal block at 0x0000022EE5678DF0, 16 bytes long.
 Data: <&#192;&#227;g&#229;.           > C0 E3 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{256} normal block at 0x0000022EE567E3C0, 40 bytes long.
 Data: <&#240; g&#229;.   `&#148; &#231;.   > F0 8D 67 E5 2E 02 00 00 60 94 19 E7 2E 02 00 00 
{255} normal block at 0x0000022EE56791B0, 16 bytes long.
 Data: <p&#231;g&#229;.           > 70 E7 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{254} normal block at 0x0000022EE56797A0, 16 bytes long.
 Data: <H&#231;g&#229;.           > 48 E7 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{253} normal block at 0x0000022EE567A760, 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 0x0000022EE5678EE0, 16 bytes long.
 Data: < &#231;g&#229;.           > 20 E7 67 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{251} normal block at 0x0000022EE567E720, 992 bytes long.
 Data: <&#224;&#142;g&#229;.   `&#167;g&#229;.   > E0 8E 67 E5 2E 02 00 00 60 A7 67 E5 2E 02 00 00 
{87} normal block at 0x0000022EE567A640, 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 0x0000022EE5678CB0, 16 bytes long.
 Data: <`&#197;f&#229;.           > 60 C5 66 E5 2E 02 00 00 00 00 00 00 00 00 00 00 
{85} normal block at 0x0000022EE566C560, 40 bytes long.
 Data: <&#176;&#140;g&#229;.   @&#166;g&#229;.   > B0 8C 67 E5 2E 02 00 00 40 A6 67 E5 2E 02 00 00 
{64} normal block at 0x0000022EE5678C10, 16 bytes long.
 Data: < &#234;F&#139;&#246;           > 80 EA 46 8B F6 7F 00 00 00 00 00 00 00 00 00 00 
{63} normal block at 0x0000022EE5678F30, 16 bytes long.
 Data: <@&#233;F&#139;&#246;           > 40 E9 46 8B F6 7F 00 00 00 00 00 00 00 00 00 00 
{62} normal block at 0x0000022EE5679840, 16 bytes long.
 Data: <&#248;WC&#139;&#246;           > F8 57 43 8B F6 7F 00 00 00 00 00 00 00 00 00 00 
{61} normal block at 0x0000022EE5678FD0, 16 bytes long.
 Data: <&#216;WC&#139;&#246;           > D8 57 43 8B F6 7F 00 00 00 00 00 00 00 00 00 00 
{60} normal block at 0x0000022EE5678B70, 16 bytes long.
 Data: <P C&#139;&#246;           > 50 04 43 8B F6 7F 00 00 00 00 00 00 00 00 00 00 
{59} normal block at 0x0000022EE56795C0, 16 bytes long.
 Data: <0 C&#139;&#246;           > 30 04 43 8B F6 7F 00 00 00 00 00 00 00 00 00 00 
{58} normal block at 0x0000022EE5678E40, 16 bytes long.
 Data: <&#224; C&#139;&#246;           > E0 02 43 8B F6 7F 00 00 00 00 00 00 00 00 00 00 
{57} normal block at 0x0000022EE5679890, 16 bytes long.
 Data: <  C&#139;&#246;           > 10 04 43 8B F6 7F 00 00 00 00 00 00 00 00 00 00 
{56} normal block at 0x0000022EE56797F0, 16 bytes long.
 Data: <p C&#139;&#246;           > 70 04 43 8B F6 7F 00 00 00 00 00 00 00 00 00 00 
{55} normal block at 0x0000022EE5679750, 16 bytes long.
 Data: < &#192;A&#139;&#246;           > 18 C0 41 8B F6 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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