Task 38625092

Name cdk8_A31_A28_r0_5-QUICO_ATM_OpenFF23_NAGL_cdk8-0-6-RND2040_0
Workunit 31575402
Created 23 Apr 2026, 9:04:41 UTC
Sent 23 Apr 2026, 9:05:07 UTC
Report deadline 28 Apr 2026, 9:05:07 UTC
Received 25 Apr 2026, 15:05:13 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 594178
Run time 2 min 3 sec
CPU time
Validate state Invalid
Credit 0.00
Device peak FLOPS 13,495.86 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 50.97 MB
Peak swap size 38.01 MB
Peak disk usage 1.52 GB

Stderr output

<core_client_version>8.0.2</core_client_version>
<![CDATA[
<message>
The operating system cannot run (null).
 (0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
13:47:01 (3797960): wrapper (7.9.26016): starting
13:47:01 (3797960): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A31_A28_0.pdb
QB_A31_A28_0.xml
QB_A31_A28.inpcrd
QB_A31_A28_input.yaml
QB_A31_A28.pdb
QB_A31_A28.prmtop
QB_A31_A28_sys.xml
run.bat
run.sh
13:47:14 (3797960): Library/usr/bin/tar.exe exited; CPU time 0.031250
13:47:14 (3797960): 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 0x000002508668E590>: 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 0x000002508669CA10>: 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 0x000002508669D250>: 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 0x000002508669DAD0>: 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 0x000002508669E390>: 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 0x000001EBFFD49790>: 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 0x000001EBFFD49D10>: 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 0x000001EBFFD4AD10>: 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 0x000001EBFFD4B850>: 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 0x000001EBFFD64490>: 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
13:48:14 (3797960): C:/Windows/system32/cmd.exe exited; CPU time 0.421875
13:48:14 (3797960): app exit status: 0x16
13:48:14 (3797960): 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: 1078795 bytes.
Dumping objects ->
{3835280} normal block at 0x00000252B17B1330, 48 bytes long.
 Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835269} normal block at 0x00000252B17B1560, 48 bytes long.
 Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835258} normal block at 0x00000252B17B0D80, 48 bytes long.
 Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61 
{3835247} normal block at 0x00000252B17B12C0, 48 bytes long.
 Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835236} normal block at 0x00000252B17B1250, 48 bytes long.
 Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61 
{3835205} normal block at 0x00000252B185DA40, 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) : {3835192} normal block at 0x00000252AFC6C1E0, 8 bytes long.
 Data: <  \&#177;R   > 00 00 5C B1 52 02 00 00 
{3833957} normal block at 0x00000252AFC6C410, 8 bytes long.
 Data: <05&#199;&#175;R   > 30 35 C7 AF 52 02 00 00 
..\zip\boinc_zip.cpp(122) : {310} normal block at 0x00000252AFC5F7B0, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{295} normal block at 0x00000252AFC5C670, 80 bytes long.
 Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C 
{294} normal block at 0x00000252AFC74030, 16 bytes long.
 Data: <&#184;R&#199;&#175;R           > B8 52 C7 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{293} normal block at 0x00000252AFC744E0, 16 bytes long.
 Data: < R&#199;&#175;R           > 90 52 C7 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{292} normal block at 0x00000252AFC70830, 32 bytes long.
 Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D 
{291} normal block at 0x00000252AFC73F90, 16 bytes long.
 Data: <hR&#199;&#175;R           > 68 52 C7 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{290} normal block at 0x00000252AFC74580, 16 bytes long.
 Data: <@R&#199;&#175;R           > 40 52 C7 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{289} normal block at 0x00000252AFC74670, 16 bytes long.
 Data: < R&#199;&#175;R           > 18 52 C7 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{288} normal block at 0x00000252AFC73BD0, 16 bytes long.
 Data: <&#240;Q&#199;&#175;R           > F0 51 C7 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{287} normal block at 0x00000252AFC6DF00, 48 bytes long.
 Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F 
{286} normal block at 0x00000252AFC74A30, 16 bytes long.
 Data: < &#229;&#197;&#175;R           > 98 E5 C5 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x00000252AFC70410, 32 bytes long.
 Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69 
{284} normal block at 0x00000252AFC745D0, 16 bytes long.
 Data: <p&#229;&#197;&#175;R           > 70 E5 C5 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x00000252AFC74120, 16 bytes long.
 Data: <H&#229;&#197;&#175;R           > 48 E5 C5 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{281} normal block at 0x00000252AFC74940, 16 bytes long.
 Data: < &#229;&#197;&#175;R           > 20 E5 C5 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{280} normal block at 0x00000252AFC743F0, 16 bytes long.
 Data: <&#248;&#228;&#197;&#175;R           > F8 E4 C5 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{279} normal block at 0x00000252AFC73DB0, 16 bytes long.
 Data: <&#208;&#228;&#197;&#175;R           > D0 E4 C5 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{278} normal block at 0x00000252AFC73D60, 16 bytes long.
 Data: <&#168;&#228;&#197;&#175;R           > A8 E4 C5 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{277} normal block at 0x00000252AFC70E30, 32 bytes long.
 Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55 
{276} normal block at 0x00000252AFC748F0, 16 bytes long.
 Data: < &#228;&#197;&#175;R           > 80 E4 C5 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{275} normal block at 0x00000252AFC5E480, 320 bytes long.
 Data: <&#240;H&#199;&#175;R   0 &#199;&#175;R   > F0 48 C7 AF 52 02 00 00 30 0E C7 AF 52 02 00 00 
{274} normal block at 0x00000252AFC74850, 16 bytes long.
 Data: <&#208;Q&#199;&#175;R           > D0 51 C7 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{273} normal block at 0x00000252AFC743A0, 16 bytes long.
 Data: <&#168;Q&#199;&#175;R           > A8 51 C7 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{272} normal block at 0x00000252AFC70D10, 32 bytes long.
 Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65 
{271} normal block at 0x00000252AFC74210, 16 bytes long.
 Data: < Q&#199;&#175;R           > 80 51 C7 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x00000252AFC70DD0, 32 bytes long.
 Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62 
{269} normal block at 0x00000252AFC74800, 16 bytes long.
 Data: <&#200;P&#199;&#175;R           > C8 50 C7 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x00000252AFC73D10, 16 bytes long.
 Data: <&#160;P&#199;&#175;R           > A0 50 C7 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{267} normal block at 0x00000252AFC73CC0, 16 bytes long.
 Data: <xP&#199;&#175;R           > 78 50 C7 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{266} normal block at 0x00000252AFC749E0, 16 bytes long.
 Data: <PP&#199;&#175;R           > 50 50 C7 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{265} normal block at 0x00000252AFC74760, 16 bytes long.
 Data: <(P&#199;&#175;R           > 28 50 C7 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{264} normal block at 0x00000252AFC74710, 16 bytes long.
 Data: < P&#199;&#175;R           > 00 50 C7 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{262} normal block at 0x00000252AFC748A0, 16 bytes long.
 Data: < &#226;&#198;&#175;R           > 10 E2 C6 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{261} normal block at 0x00000252AFC6E210, 40 bytes long.
 Data: <&#160;H&#199;&#175;R   @&#218;&#133;&#177;R   > A0 48 C7 AF 52 02 00 00 40 DA 85 B1 52 02 00 00 
{260} normal block at 0x00000252AFC74990, 16 bytes long.
 Data: <&#224;O&#199;&#175;R           > E0 4F C7 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{259} normal block at 0x00000252AFC747B0, 16 bytes long.
 Data: <&#184;O&#199;&#175;R           > B8 4F C7 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{258} normal block at 0x00000252AFC709B0, 32 bytes long.
 Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F 
{257} normal block at 0x00000252AFC74530, 16 bytes long.
 Data: < O&#199;&#175;R           > 90 4F C7 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{256} normal block at 0x00000252AFC74F90, 992 bytes long.
 Data: <0E&#199;&#175;R   &#176;	&#199;&#175;R   > 30 45 C7 AF 52 02 00 00 B0 09 C7 AF 52 02 00 00 
{92} normal block at 0x00000252AFC70B90, 32 bytes long.
 Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F 
{91} normal block at 0x00000252AFC6C140, 16 bytes long.
 Data: < &#226;&#198;&#175;R           > 80 E2 C6 AF 52 02 00 00 00 00 00 00 00 00 00 00 
{90} normal block at 0x00000252AFC6E280, 40 bytes long.
 Data: <@&#193;&#198;&#175;R     &#199;&#175;R   > 40 C1 C6 AF 52 02 00 00 90 0B C7 AF 52 02 00 00 
{69} normal block at 0x00000252AFC6C2D0, 16 bytes long.
 Data: < &#234;&#212;&#252;&#246;           > 80 EA D4 FC F6 7F 00 00 00 00 00 00 00 00 00 00 
{68} normal block at 0x00000252AFC6B970, 16 bytes long.
 Data: <@&#233;&#212;&#252;&#246;           > 40 E9 D4 FC F6 7F 00 00 00 00 00 00 00 00 00 00 
{67} normal block at 0x00000252AFC6BFB0, 16 bytes long.
 Data: <&#248;W&#209;&#252;&#246;           > F8 57 D1 FC F6 7F 00 00 00 00 00 00 00 00 00 00 
{66} normal block at 0x00000252AFC6C5F0, 16 bytes long.
 Data: <&#216;W&#209;&#252;&#246;           > D8 57 D1 FC F6 7F 00 00 00 00 00 00 00 00 00 00 
{65} normal block at 0x00000252AFC6BD80, 16 bytes long.
 Data: <P &#209;&#252;&#246;           > 50 04 D1 FC F6 7F 00 00 00 00 00 00 00 00 00 00 
{64} normal block at 0x00000252AFC6B830, 16 bytes long.
 Data: <0 &#209;&#252;&#246;           > 30 04 D1 FC F6 7F 00 00 00 00 00 00 00 00 00 00 
{63} normal block at 0x00000252AFC6C6E0, 16 bytes long.
 Data: <&#224; &#209;&#252;&#246;           > E0 02 D1 FC F6 7F 00 00 00 00 00 00 00 00 00 00 
{62} normal block at 0x00000252AFC6BAB0, 16 bytes long.
 Data: <  &#209;&#252;&#246;           > 10 04 D1 FC F6 7F 00 00 00 00 00 00 00 00 00 00 
{61} normal block at 0x00000252AFC6B7E0, 16 bytes long.
 Data: <p &#209;&#252;&#246;           > 70 04 D1 FC F6 7F 00 00 00 00 00 00 00 00 00 00 
{60} normal block at 0x00000252AFC6BB50, 16 bytes long.
 Data: < &#192;&#207;&#252;&#246;           > 18 C0 CF FC F6 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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