Task 38581691

Name JNK1_A28_A14_r2_1-QUICO_ATM_GAFF2_LOMAP_JNK1_3-2-5-RND4074_0
Workunit 31546143
Created 12 Dec 2025, 13:06:38 UTC
Sent 12 Dec 2025, 13:06:39 UTC
Report deadline 17 Dec 2025, 13:06:39 UTC
Received 13 Dec 2025, 11:39:34 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 546853
Run time 15 hours 41 min 10 sec
CPU time 15 hours 36 min 18 sec
Validate state Invalid
Credit 0.00
Device peak FLOPS 4,574.08 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 693.18 MB
Peak swap size 12.76 GB
Peak disk usage 3.56 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>
22:57:31 (30676): wrapper (7.9.26016): starting
22:57:31 (30676): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A28_A14_0.pdb
QB_A28_A14_0.xml
QB_A28_A14_equil.pdb
QB_A28_A14.inpcrd
QB_A28_A14_input.yaml
QB_A28_A14_mdlambda.pdb
QB_A28_A14_min.pdb
QB_A28_A14_npt.pdb
QB_A28_A14_out_merged_nowater.pdb
QB_A28_A14.pdb
QB_A28_A14.prmtop
QB_A28_A14_sys.xml
QB_A28_A14_therm.pdb
run.bat
run.sh
22:57:36 (30676): Library/usr/bin/tar.exe exited; CPU time 0.015625
22:57:36 (30676): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
'doskey' is not recognized as an internal or external command,
operable program or batch file.
'doskey' is not recognized as an internal or external command,
operable program or batch file.
  WARNING: The script pyaml.exe is installed in 'X:\BOINC\slots\26\Scripts' which is not on PATH.
  Consider adding this directory to PATH or, if you prefer to suppress this warning, use --no-warn-script-location.
  WARNING: The scripts abfe_production.exe, abfe_structprep.exe, make_atm_system_from_amber.exe, make_atm_system_from_pdb.exe, make_atm_system_from_rcpt_lig.exe, rbfe_production.exe and rbfe_structprep.exe are installed in 'X:\BOINC\slots\26\Scripts' which is not on PATH.
  Consider adding this directory to PATH or, if you prefer to suppress this warning, use --no-warn-script-location.
Warning: importing 'simtk.openmm' is deprecated.  Import 'openmm' instead.
tar: run.log: file changed as we read it
tar: r*/*.dcd: Cannot stat: No such file or directory
tar: Exiting with failure status due to previous errors
14:37:44 (30676): C:/Windows/system32/cmd.exe exited; CPU time 56178.968750
14:37:44 (30676): app exit status: 0x1
14:37:44 (30676): called boinc_finish(195)
0 bytes in 0 Free Blocks.
380 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: 1123102873 bytes.
Dumping objects ->
{3835272} normal block at 0x0000024BF611C2C0, 48 bytes long.
 Data: <PATH=X:\BOINC\sl> 50 41 54 48 3D 58 3A 5C 42 4F 49 4E 43 5C 73 6C 
{3835261} normal block at 0x0000024BF7EECCA0, 32 bytes long.
 Data: <HOME=X:\BOINC\sl> 48 4F 4D 45 3D 58 3A 5C 42 4F 49 4E 43 5C 73 6C 
{3835250} normal block at 0x0000024BF7EEC400, 32 bytes long.
 Data: <TMP=X:\BOINC\slo> 54 4D 50 3D 58 3A 5C 42 4F 49 4E 43 5C 73 6C 6F 
{3835239} normal block at 0x0000024BF7EED000, 32 bytes long.
 Data: <TEMP=X:\BOINC\sl> 54 45 4D 50 3D 58 3A 5C 42 4F 49 4E 43 5C 73 6C 
{3835228} normal block at 0x0000024BF7EECE20, 32 bytes long.
 Data: <TMPDIR=X:\BOINC\> 54 4D 50 44 49 52 3D 58 3A 5C 42 4F 49 4E 43 5C 
{3835197} normal block at 0x0000024BF611C870, 48 bytes long.
 Data: <PATH=X:\BOINC\sl> 50 41 54 48 3D 58 3A 5C 42 4F 49 4E 43 5C 73 6C 
{3835186} normal block at 0x0000024BF7EB5800, 102 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) : {3835183} normal block at 0x0000024BF6117500, 8 bytes long.
 Data: <  &#192;&#247;K   > 00 00 C0 F7 4B 02 00 00 
{3834579} normal block at 0x0000024BF7EB56A0, 102 bytes long.
 Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65 
{3833999} normal block at 0x0000024BF6117640, 8 bytes long.
 Data: <pD&#235;&#247;K   > 70 44 EB F7 4B 02 00 00 
..\zip\boinc_zip.cpp(122) : {331} normal block at 0x0000024BF6119930, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{316} normal block at 0x0000024BF60FAB20, 80 bytes long.
 Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C 
{315} normal block at 0x0000024BF611DC30, 16 bytes long.
 Data: <H&#191; &#246;K           > 48 BF 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{314} normal block at 0x0000024BF611D5A0, 16 bytes long.
 Data: < &#191; &#246;K           > 20 BF 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{313} normal block at 0x0000024BF611B950, 32 bytes long.
 Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D 
{312} normal block at 0x0000024BF611DD20, 16 bytes long.
 Data: <&#248;&#190; &#246;K           > F8 BE 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{311} normal block at 0x0000024BF611DBE0, 16 bytes long.
 Data: <&#208;&#190; &#246;K           > D0 BE 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{310} normal block at 0x0000024BF611D230, 16 bytes long.
 Data: <&#168;&#190; &#246;K           > A8 BE 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{309} normal block at 0x0000024BF611D190, 16 bytes long.
 Data: <&#128;&#190; &#246;K           > 80 BE 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{308} normal block at 0x0000024BF611C8E0, 48 bytes long.
 Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F 
{307} normal block at 0x0000024BF611D550, 16 bytes long.
 Data: <&#216;  &#246;K           > D8 17 10 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{306} normal block at 0x0000024BF611B2F0, 32 bytes long.
 Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69 
{305} normal block at 0x0000024BF611D6E0, 16 bytes long.
 Data: <&#176;  &#246;K           > B0 17 10 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{303} normal block at 0x0000024BF611DB90, 16 bytes long.
 Data: <   &#246;K           > 88 17 10 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{302} normal block at 0x0000024BF611DE60, 16 bytes long.
 Data: <`  &#246;K           > 60 17 10 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{301} normal block at 0x0000024BF611DDC0, 16 bytes long.
 Data: <8  &#246;K           > 38 17 10 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{300} normal block at 0x0000024BF611DD70, 16 bytes long.
 Data: <   &#246;K           > 10 17 10 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{299} normal block at 0x0000024BF611D690, 16 bytes long.
 Data: <&#232;  &#246;K           > E8 16 10 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{298} normal block at 0x0000024BF611B530, 32 bytes long.
 Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55 
{297} normal block at 0x0000024BF611D4B0, 16 bytes long.
 Data: <&#192;  &#246;K           > C0 16 10 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{296} normal block at 0x0000024BF61016C0, 320 bytes long.
 Data: <&#176;&#212; &#246;K   0&#181; &#246;K   > B0 D4 11 F6 4B 02 00 00 30 B5 11 F6 4B 02 00 00 
{295} normal block at 0x0000024BF611DA00, 16 bytes long.
 Data: <`&#190; &#246;K           > 60 BE 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{294} normal block at 0x0000024BF611D9B0, 16 bytes long.
 Data: <8&#190; &#246;K           > 38 BE 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{293} normal block at 0x0000024BF611B650, 32 bytes long.
 Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65 
{292} normal block at 0x0000024BF611D320, 16 bytes long.
 Data: < &#190; &#246;K           > 10 BE 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{291} normal block at 0x0000024BF611B110, 32 bytes long.
 Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62 
{290} normal block at 0x0000024BF611D640, 16 bytes long.
 Data: <X&#189; &#246;K           > 58 BD 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{289} normal block at 0x0000024BF611D820, 16 bytes long.
 Data: <0&#189; &#246;K           > 30 BD 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{288} normal block at 0x0000024BF611D2D0, 16 bytes long.
 Data: < &#189; &#246;K           > 08 BD 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{287} normal block at 0x0000024BF611D5F0, 16 bytes long.
 Data: <&#224;&#188; &#246;K           > E0 BC 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{286} normal block at 0x0000024BF6117460, 16 bytes long.
 Data: <&#184;&#188; &#246;K           > B8 BC 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x0000024BF6117410, 16 bytes long.
 Data: <&#144;&#188; &#246;K           > 90 BC 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{283} normal block at 0x0000024BF6117140, 16 bytes long.
 Data: <&#240;&#196; &#246;K           > F0 C4 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x0000024BF611C4F0, 40 bytes long.
 Data: <@q &#246;K   p&#200; &#246;K   > 40 71 11 F6 4B 02 00 00 70 C8 11 F6 4B 02 00 00 
{281} normal block at 0x0000024BF6116DD0, 16 bytes long.
 Data: <p&#188; &#246;K           > 70 BC 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{280} normal block at 0x0000024BF6117820, 16 bytes long.
 Data: <H&#188; &#246;K           > 48 BC 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{279} normal block at 0x0000024BF611B470, 32 bytes long.
 Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F 
{278} normal block at 0x0000024BF6116D80, 16 bytes long.
 Data: < &#188; &#246;K           > 20 BC 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{277} normal block at 0x0000024BF611BC20, 992 bytes long.
 Data: <&#128;m &#246;K   p&#180; &#246;K   > 80 6D 11 F6 4B 02 00 00 70 B4 11 F6 4B 02 00 00 
{113} normal block at 0x0000024BF610F0B0, 32 bytes long.
 Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F 
{112} normal block at 0x0000024BF6117B40, 16 bytes long.
 Data: <&#224;I &#246;K           > E0 49 11 F6 4B 02 00 00 00 00 00 00 00 00 00 00 
{111} normal block at 0x0000024BF61149E0, 40 bytes long.
 Data: <@{ &#246;K   &#176;&#240; &#246;K   > 40 7B 11 F6 4B 02 00 00 B0 F0 10 F6 4B 02 00 00 
{90} normal block at 0x0000024BF6116CE0, 16 bytes long.
 Data: <&#128;&#234;&#246;&#180;&#247;           > 80 EA F6 B4 F7 7F 00 00 00 00 00 00 00 00 00 00 
{89} normal block at 0x0000024BF6116E70, 16 bytes long.
 Data: <@&#233;&#246;&#180;&#247;           > 40 E9 F6 B4 F7 7F 00 00 00 00 00 00 00 00 00 00 
{88} normal block at 0x0000024BF6117960, 16 bytes long.
 Data: <&#248;W&#243;&#180;&#247;           > F8 57 F3 B4 F7 7F 00 00 00 00 00 00 00 00 00 00 
{87} normal block at 0x0000024BF61179B0, 16 bytes long.
 Data: <&#216;W&#243;&#180;&#247;           > D8 57 F3 B4 F7 7F 00 00 00 00 00 00 00 00 00 00 
{86} normal block at 0x0000024BF61177D0, 16 bytes long.
 Data: <P &#243;&#180;&#247;           > 50 04 F3 B4 F7 7F 00 00 00 00 00 00 00 00 00 00 
{85} normal block at 0x0000024BF6117050, 16 bytes long.
 Data: <0 &#243;&#180;&#247;           > 30 04 F3 B4 F7 7F 00 00 00 00 00 00 00 00 00 00 
{84} normal block at 0x0000024BF6116EC0, 16 bytes long.
 Data: <&#224; &#243;&#180;&#247;           > E0 02 F3 B4 F7 7F 00 00 00 00 00 00 00 00 00 00 
{83} normal block at 0x0000024BF61170F0, 16 bytes long.
 Data: <  &#243;&#180;&#247;           > 10 04 F3 B4 F7 7F 00 00 00 00 00 00 00 00 00 00 
{82} normal block at 0x0000024BF61176E0, 16 bytes long.
 Data: <p &#243;&#180;&#247;           > 70 04 F3 B4 F7 7F 00 00 00 00 00 00 00 00 00 00 
{81} normal block at 0x0000024BF610CD70, 16 bytes long.
 Data: < &#192;&#241;&#180;&#247;           > 18 C0 F1 B4 F7 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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