Task 38625258

Name PTP1B_A20_A18_r0_2-QUICO_ATM_OpenFF23_NAGL_PTP1B-1-6-RND8960_0
Workunit 31575510
Created 23 Apr 2026, 12:55:28 UTC
Sent 23 Apr 2026, 12:55:33 UTC
Report deadline 28 Apr 2026, 12:55:33 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 1 min 28 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 50.30 MB
Peak swap size 37.32 MB
Peak disk usage 1.48 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>
13:49:11 (3633648): wrapper (7.9.26016): starting
13:49:11 (3633648): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A20_A18_0.pdb
QB_A20_A18_0.xml
QB_A20_A18.inpcrd
QB_A20_A18_input.yaml
QB_A20_A18.pdb
QB_A20_A18.prmtop
QB_A20_A18_sys.xml
run.bat
run.sh
13:49:24 (3633648): Library/usr/bin/tar.exe exited; CPU time 0.046875
13:49:24 (3633648): 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 0x000002113774FE10>: 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 0x000002113775CAD0>: 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 0x000002113775D290>: 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 0x000002113775DB10>: 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 0x000002113775E3D0>: 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 0x0000015F5A009790>: 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 0x0000015F5A009D10>: 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 0x0000015F5A00AD10>: 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 0x0000015F5A00B850>: 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 0x0000015F5A024490>: 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
13:49:51 (3633648): C:/Windows/system32/cmd.exe exited; CPU time 0.078125
13:49:51 (3633648): app exit status: 0x16
13:49:51 (3633648): 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: 699381 bytes.
Dumping objects ->
{3835280} normal block at 0x000002440BE71090, 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 0x000002440BE70CA0, 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 0x000002440BE71480, 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 0x000002440BE70AE0, 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 0x000002440BE71410, 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 0x000002440BF1CF40, 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 0x000002440A23B900, 8 bytes long.
 Data: <    D   > 00 00 08 0C 44 02 00 00 
{3833957} normal block at 0x000002440A23C3F0, 8 bytes long.
 Data: <&#224;&#201;" D   > E0 C9 22 0A 44 02 00 00 
..\zip\boinc_zip.cpp(122) : {310} normal block at 0x000002440A22FCB0, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{295} normal block at 0x000002440A22C670, 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 0x000002440A2449E0, 16 bytes long.
 Data: <&#184;R$ D           > B8 52 24 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{293} normal block at 0x000002440A244120, 16 bytes long.
 Data: < R$ D           > 90 52 24 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{292} normal block at 0x000002440A2400B0, 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 0x000002440A244990, 16 bytes long.
 Data: <hR$ D           > 68 52 24 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{290} normal block at 0x000002440A243C20, 16 bytes long.
 Data: <@R$ D           > 40 52 24 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{289} normal block at 0x000002440A244A30, 16 bytes long.
 Data: < R$ D           > 18 52 24 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{288} normal block at 0x000002440A244080, 16 bytes long.
 Data: <&#240;Q$ D           > F0 51 24 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{287} normal block at 0x000002440A23E490, 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 0x000002440A243FE0, 16 bytes long.
 Data: < &#229;" D           > 98 E5 22 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x000002440A240170, 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 0x000002440A244170, 16 bytes long.
 Data: <p&#229;" D           > 70 E5 22 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x000002440A2443F0, 16 bytes long.
 Data: <H&#229;" D           > 48 E5 22 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{281} normal block at 0x000002440A244B20, 16 bytes long.
 Data: < &#229;" D           > 20 E5 22 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{280} normal block at 0x000002440A244AD0, 16 bytes long.
 Data: <&#248;&#228;" D           > F8 E4 22 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{279} normal block at 0x000002440A244620, 16 bytes long.
 Data: <&#208;&#228;" D           > D0 E4 22 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{278} normal block at 0x000002440A2443A0, 16 bytes long.
 Data: <&#168;&#228;" D           > A8 E4 22 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{277} normal block at 0x000002440A2405F0, 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 0x000002440A243D60, 16 bytes long.
 Data: < &#228;" D           > 80 E4 22 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{275} normal block at 0x000002440A22E480, 320 bytes long.
 Data: <`=$ D   &#240; $ D   > 60 3D 24 0A 44 02 00 00 F0 05 24 0A 44 02 00 00 
{274} normal block at 0x000002440A244530, 16 bytes long.
 Data: <&#208;Q$ D           > D0 51 24 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{273} normal block at 0x000002440A243F90, 16 bytes long.
 Data: <&#168;Q$ D           > A8 51 24 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{272} normal block at 0x000002440A240EF0, 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 0x000002440A244260, 16 bytes long.
 Data: < Q$ D           > 80 51 24 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x000002440A2404D0, 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 0x000002440A243BD0, 16 bytes long.
 Data: <&#200;P$ D           > C8 50 24 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x000002440A243DB0, 16 bytes long.
 Data: <&#160;P$ D           > A0 50 24 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{267} normal block at 0x000002440A244A80, 16 bytes long.
 Data: <xP$ D           > 78 50 24 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{266} normal block at 0x000002440A2447B0, 16 bytes long.
 Data: <PP$ D           > 50 50 24 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{265} normal block at 0x000002440A243D10, 16 bytes long.
 Data: <(P$ D           > 28 50 24 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{264} normal block at 0x000002440A243EA0, 16 bytes long.
 Data: < P$ D           > 00 50 24 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{262} normal block at 0x000002440A244350, 16 bytes long.
 Data: <&#208;&#226;# D           > D0 E2 23 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{261} normal block at 0x000002440A23E2D0, 40 bytes long.
 Data: <PC$ D   @&#207;&#241; D   > 50 43 24 0A 44 02 00 00 40 CF F1 0B 44 02 00 00 
{260} normal block at 0x000002440A243F40, 16 bytes long.
 Data: <&#224;O$ D           > E0 4F 24 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{259} normal block at 0x000002440A244670, 16 bytes long.
 Data: <&#184;O$ D           > B8 4F 24 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{258} normal block at 0x000002440A2408F0, 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 0x000002440A244940, 16 bytes long.
 Data: < O$ D           > 90 4F 24 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{256} normal block at 0x000002440A244F90, 992 bytes long.
 Data: <@I$ D   &#240; $ D   > 40 49 24 0A 44 02 00 00 F0 08 24 0A 44 02 00 00 
{92} normal block at 0x000002440A240470, 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 0x000002440A23B770, 16 bytes long.
 Data: <&#160;&#224;# D           > A0 E0 23 0A 44 02 00 00 00 00 00 00 00 00 00 00 
{90} normal block at 0x000002440A23E0A0, 40 bytes long.
 Data: <p&#183;# D   p $ D   > 70 B7 23 0A 44 02 00 00 70 04 24 0A 44 02 00 00 
{69} normal block at 0x000002440A23BF90, 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 0x000002440A23BBD0, 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 0x000002440A23C0D0, 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 0x000002440A23BF40, 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 0x000002440A23BFE0, 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 0x000002440A23C120, 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 0x000002440A23B860, 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 0x000002440A23C670, 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 0x000002440A23BD10, 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 0x000002440A23B810, 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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