Task 38608774

Name MCL1_A34_A04_r0_3-QUICO_ATM_OpenFF_MCL1-3-6-RND8423_0
Workunit 31561987
Created 14 Apr 2026, 18:23:24 UTC
Sent 14 Apr 2026, 18:23:27 UTC
Report deadline 19 Apr 2026, 18:23:27 UTC
Received 15 Apr 2026, 10:04:31 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 17 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 49.05 MB
Peak swap size 38.25 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>
09:51:34 (17360): wrapper (7.9.26016): starting
09:51:34 (17360): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A34_A04_0.pdb
QB_A34_A04_0.xml
QB_A34_A04.inpcrd
QB_A34_A04_input.yaml
QB_A34_A04.pdb
QB_A34_A04.prmtop
QB_A34_A04_sys.xml
run.bat
run.sh
09:51:35 (17360): Library/usr/bin/tar.exe exited; CPU time 0.000000
09:51:35 (17360): 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 0x000002AA7F361B10>: 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 0x000002AA7F7A8690>: 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 0x000002AA7F7A8F90>: 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 0x000002AA7F7A97D0>: 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 0x000002AA7F7AA0D0>: 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 0x000001C2ADF6CAD0>: 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 0x000001C2ADF6E690>: 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 0x000001C2ADF6EFD0>: 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 0x000001C2ADF6FB50>: 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 0x000001C2ADF807D0>: 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
09:51:59 (17360): C:/Windows/system32/cmd.exe exited; CPU time 1.687500
09:51:59 (17360): app exit status: 0x16
09:51:59 (17360): 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: 442223 bytes.
Dumping objects ->
{3835308} normal block at 0x0000025AC9AE0B50, 48 bytes long.
 Data: <PATH=D:\BOINCDAT> 50 41 54 48 3D 44 3A 5C 42 4F 49 4E 43 44 41 54 
{3835297} normal block at 0x0000025AC9C3DD80, 32 bytes long.
 Data: <HOME=D:\BOINCDAT> 48 4F 4D 45 3D 44 3A 5C 42 4F 49 4E 43 44 41 54 
{3835286} normal block at 0x0000025AC9C3D780, 32 bytes long.
 Data: <TMP=D:\BOINCDATA> 54 4D 50 3D 44 3A 5C 42 4F 49 4E 43 44 41 54 41 
{3835275} normal block at 0x0000025AC9C3CC40, 32 bytes long.
 Data: <TEMP=D:\BOINCDAT> 54 45 4D 50 3D 44 3A 5C 42 4F 49 4E 43 44 41 54 
{3835264} normal block at 0x0000025AC9C3DAE0, 32 bytes long.
 Data: <TMPDIR=D:\BOINCD> 54 4D 50 44 49 52 3D 44 3A 5C 42 4F 49 4E 43 44 
{3835233} normal block at 0x0000025AC9AE0920, 48 bytes long.
 Data: <PATH=D:\BOINCDAT> 50 41 54 48 3D 44 3A 5C 42 4F 49 4E 43 44 41 54 
{3835222} normal block at 0x0000025AC9C7B0D0, 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) : {3835219} normal block at 0x0000025AC810CD10, 8 bytes long.
 Data: <  	&#200;Z   > 00 00 09 C8 5A 02 00 00 
{3834578} normal block at 0x0000025AC9C7A860, 180 bytes long.
 Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65 
{3833949} normal block at 0x0000025AC810C9F0, 8 bytes long.
 Data: <&#176;Z &#200;Z   > B0 5A 0F C8 5A 02 00 00 
..\zip\boinc_zip.cpp(122) : {306} normal block at 0x0000025AC81076F0, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{291} normal block at 0x0000025AC80F4B20, 80 bytes long.
 Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C 
{290} normal block at 0x0000025AC810C1D0, 16 bytes long.
 Data: <8&#210; &#200;Z           > 38 D2 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{289} normal block at 0x0000025AC810CCC0, 16 bytes long.
 Data: < &#210; &#200;Z           > 10 D2 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{288} normal block at 0x0000025AC8108180, 32 bytes long.
 Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D 
{287} normal block at 0x0000025AC810C900, 16 bytes long.
 Data: <&#232;&#209; &#200;Z           > E8 D1 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{286} normal block at 0x0000025AC810C450, 16 bytes long.
 Data: <&#192;&#209; &#200;Z           > C0 D1 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x0000025AC810C8B0, 16 bytes long.
 Data: < &#209; &#200;Z           > 98 D1 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{284} normal block at 0x0000025AC810CE00, 16 bytes long.
 Data: <p&#209; &#200;Z           > 70 D1 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{283} normal block at 0x0000025AC8106C10, 48 bytes long.
 Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F 
{282} normal block at 0x0000025AC810C3B0, 16 bytes long.
 Data: <&#184;J &#200;Z           > B8 4A 0F C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{281} normal block at 0x0000025AC8108120, 32 bytes long.
 Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69 
{280} normal block at 0x0000025AC810C130, 16 bytes long.
 Data: < J &#200;Z           > 90 4A 0F C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{278} normal block at 0x0000025AC810CD60, 16 bytes long.
 Data: <hJ &#200;Z           > 68 4A 0F C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{277} normal block at 0x0000025AC810C770, 16 bytes long.
 Data: <@J &#200;Z           > 40 4A 0F C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{276} normal block at 0x0000025AC810C0E0, 16 bytes long.
 Data: < J &#200;Z           > 18 4A 0F C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{275} normal block at 0x0000025AC810C270, 16 bytes long.
 Data: <&#240;I &#200;Z           > F0 49 0F C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{274} normal block at 0x0000025AC810C5E0, 16 bytes long.
 Data: <&#200;I &#200;Z           > C8 49 0F C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{273} normal block at 0x0000025AC8108300, 32 bytes long.
 Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55 
{272} normal block at 0x0000025AC810C540, 16 bytes long.
 Data: <&#160;I &#200;Z           > A0 49 0F C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{271} normal block at 0x0000025AC80F49A0, 320 bytes long.
 Data: <@&#197; &#200;Z    &#131; &#200;Z   > 40 C5 10 C8 5A 02 00 00 00 83 10 C8 5A 02 00 00 
{270} normal block at 0x0000025AC810BFA0, 16 bytes long.
 Data: <P&#209; &#200;Z           > 50 D1 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{269} normal block at 0x0000025AC810C860, 16 bytes long.
 Data: <(&#209; &#200;Z           > 28 D1 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x0000025AC8107E80, 32 bytes long.
 Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65 
{267} normal block at 0x0000025AC810C4A0, 16 bytes long.
 Data: < &#209; &#200;Z           > 00 D1 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{266} normal block at 0x0000025AC8108780, 32 bytes long.
 Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62 
{265} normal block at 0x0000025AC810C310, 16 bytes long.
 Data: <H&#208; &#200;Z           > 48 D0 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{264} normal block at 0x0000025AC810C090, 16 bytes long.
 Data: < &#208; &#200;Z           > 20 D0 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{263} normal block at 0x0000025AC810C040, 16 bytes long.
 Data: <&#248;&#207; &#200;Z           > F8 CF 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{262} normal block at 0x0000025AC810C720, 16 bytes long.
 Data: <&#208;&#207; &#200;Z           > D0 CF 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{261} normal block at 0x0000025AC810C680, 16 bytes long.
 Data: <&#168;&#207; &#200;Z           > A8 CF 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{260} normal block at 0x0000025AC810C220, 16 bytes long.
 Data: < &#207; &#200;Z           > 80 CF 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{258} normal block at 0x0000025AC810CA90, 16 bytes long.
 Data: <0k &#200;Z           > 30 6B 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{257} normal block at 0x0000025AC8106B30, 40 bytes long.
 Data: < &#202; &#200;Z    	&#174;&#201;Z   > 90 CA 10 C8 5A 02 00 00 20 09 AE C9 5A 02 00 00 
{256} normal block at 0x0000025AC810C400, 16 bytes long.
 Data: <`&#207; &#200;Z           > 60 CF 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{255} normal block at 0x0000025AC810C9A0, 16 bytes long.
 Data: <8&#207; &#200;Z           > 38 CF 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{254} normal block at 0x0000025AC8107C40, 32 bytes long.
 Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F 
{253} normal block at 0x0000025AC810C7C0, 16 bytes long.
 Data: < &#207; &#200;Z           > 10 CF 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{252} normal block at 0x0000025AC810CF10, 992 bytes long.
 Data: <&#192;&#199; &#200;Z   @| &#200;Z   > C0 C7 10 C8 5A 02 00 00 40 7C 10 C8 5A 02 00 00 
{88} normal block at 0x0000025AC8107DC0, 32 bytes long.
 Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F 
{87} normal block at 0x0000025AC8100440, 16 bytes long.
 Data: <Pj &#200;Z           > 50 6A 10 C8 5A 02 00 00 00 00 00 00 00 00 00 00 
{86} normal block at 0x0000025AC8106A50, 40 bytes long.
 Data: <@  &#200;Z   &#192;} &#200;Z   > 40 04 10 C8 5A 02 00 00 C0 7D 10 C8 5A 02 00 00 
{65} normal block at 0x0000025AC81003F0, 16 bytes long.
 Data: < &#234;&#210;&#186;&#247;           > 80 EA D2 BA F7 7F 00 00 00 00 00 00 00 00 00 00 
{64} normal block at 0x0000025AC80FF900, 16 bytes long.
 Data: <@&#233;&#210;&#186;&#247;           > 40 E9 D2 BA F7 7F 00 00 00 00 00 00 00 00 00 00 
{63} normal block at 0x0000025AC80FF810, 16 bytes long.
 Data: <&#248;W&#207;&#186;&#247;           > F8 57 CF BA F7 7F 00 00 00 00 00 00 00 00 00 00 
{62} normal block at 0x0000025AC81001C0, 16 bytes long.
 Data: <&#216;W&#207;&#186;&#247;           > D8 57 CF BA F7 7F 00 00 00 00 00 00 00 00 00 00 
{61} normal block at 0x0000025AC80FF8B0, 16 bytes long.
 Data: <P &#207;&#186;&#247;           > 50 04 CF BA F7 7F 00 00 00 00 00 00 00 00 00 00 
{60} normal block at 0x0000025AC80FF7C0, 16 bytes long.
 Data: <0 &#207;&#186;&#247;           > 30 04 CF BA F7 7F 00 00 00 00 00 00 00 00 00 00 
{59} normal block at 0x0000025AC8100710, 16 bytes long.
 Data: <&#224; &#207;&#186;&#247;           > E0 02 CF BA F7 7F 00 00 00 00 00 00 00 00 00 00 
{58} normal block at 0x0000025AC81002B0, 16 bytes long.
 Data: <  &#207;&#186;&#247;           > 10 04 CF BA F7 7F 00 00 00 00 00 00 00 00 00 00 
{57} normal block at 0x0000025AC8100080, 16 bytes long.
 Data: <p &#207;&#186;&#247;           > 70 04 CF BA F7 7F 00 00 00 00 00 00 00 00 00 00 
{56} normal block at 0x0000025AC8100350, 16 bytes long.
 Data: < &#192;&#205;&#186;&#247;           > 18 C0 CD BA F7 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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