Task 38601785

Name PTP1B_A07_A15_r0_3-QUICO_ATM_GAFF2_NAGL_PTP1B-1-6-RND7805_0
Workunit 31556292
Created 9 Apr 2026, 17:36:18 UTC
Sent 9 Apr 2026, 17:36:27 UTC
Report deadline 14 Apr 2026, 17:36:27 UTC
Received 10 Apr 2026, 0:25:08 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 638290
Run time 1 min 30 sec
CPU time 17 sec
Validate state Invalid
Credit 0.00
Device peak FLOPS 52,232.87 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 327.69 MB
Peak swap size 12.18 GB
Peak disk usage 1.56 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>
20:22:45 (30584): wrapper (7.9.26016): starting
20:22:45 (30584): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A07_A15_0.pdb
QB_A07_A15_0.xml
QB_A07_A15.inpcrd
QB_A07_A15_input.yaml
QB_A07_A15.pdb
QB_A07_A15.prmtop
QB_A07_A15_sys.xml
run.bat
run.sh
20:22:47 (30584): Library/usr/bin/tar.exe exited; CPU time 0.000000
20:22:47 (30584): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
  WARNING: The script pyaml.exe is installed in 'C:\ProgramData\BOINC\slots\32\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 'C:\ProgramData\BOINC\slots\32\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.

bzip2: Data integrity error when decompressing.
	Input file = (stdin), output file = (stdout)

It is possible that the compressed file(s) have become corrupted.
You can use the -tvv option to test integrity of such files.

You can use the `bzip2recover' program to attempt to recover
data from undamaged sections of corrupted files.

tar: Unexpected EOF in archive
tar: Unexpected EOF in archive
tar: Error is not recoverable: exiting now
Warning: importing 'simtk.openmm' is deprecated.  Import 'openmm' instead.
20:23:23 (30584): C:/Windows/system32/cmd.exe exited; CPU time 17.859375
20:23:23 (30584): app exit status: 0x16
20:23:23 (30584): 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: 1001661 bytes.
Dumping objects ->
{3835270} normal block at 0x0000024EB32EDB20, 48 bytes long.
 Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835259} normal block at 0x0000024EB16459B0, 48 bytes long.
 Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835248} normal block at 0x0000024EB1645D30, 48 bytes long.
 Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61 
{3835237} normal block at 0x0000024EB1645FD0, 48 bytes long.
 Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835226} normal block at 0x0000024EB1645A90, 48 bytes long.
 Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61 
{3835195} normal block at 0x0000024EB33370F0, 64 bytes long.
 Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835184} normal block at 0x0000024EB3394C80, 140 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) : {3835181} normal block at 0x0000024EB163EA40, 8 bytes long.
 Data: <  &#160;&#177;N   > 00 00 A0 B1 4E 02 00 00 
{3834563} normal block at 0x0000024EB3395300, 140 bytes long.
 Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65 
{3833957} normal block at 0x0000024EB163E720, 8 bytes long.
 Data: < &#191;f&#177;N   > 20 BF 66 B1 4E 02 00 00 
..\zip\boinc_zip.cpp(122) : {310} normal block at 0x0000024EB1631F80, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{295} normal block at 0x0000024EB1632A20, 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 0x0000024EB1647050, 16 bytes long.
 Data: <8td&#177;N           > 38 74 64 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{293} normal block at 0x0000024EB1647000, 16 bytes long.
 Data: < td&#177;N           > 10 74 64 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{292} normal block at 0x0000024EB1642020, 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 0x0000024EB1646560, 16 bytes long.
 Data: <&#232;sd&#177;N           > E8 73 64 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{290} normal block at 0x0000024EB1646970, 16 bytes long.
 Data: <&#192;sd&#177;N           > C0 73 64 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{289} normal block at 0x0000024EB1646880, 16 bytes long.
 Data: < sd&#177;N           > 98 73 64 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{288} normal block at 0x0000024EB16467E0, 16 bytes long.
 Data: <psd&#177;N           > 70 73 64 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{287} normal block at 0x0000024EB1645DA0, 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 0x0000024EB1646920, 16 bytes long.
 Data: <h$c&#177;N           > 68 24 63 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x0000024EB1642080, 32 bytes long.
 Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69 
{284} normal block at 0x0000024EB1646790, 16 bytes long.
 Data: <@$c&#177;N           > 40 24 63 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x0000024EB1646510, 16 bytes long.
 Data: < $c&#177;N           > 18 24 63 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{281} normal block at 0x0000024EB1646380, 16 bytes long.
 Data: <&#240;#c&#177;N           > F0 23 63 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{280} normal block at 0x0000024EB16468D0, 16 bytes long.
 Data: <&#200;#c&#177;N           > C8 23 63 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{279} normal block at 0x0000024EB16466A0, 16 bytes long.
 Data: <&#160;#c&#177;N           > A0 23 63 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{278} normal block at 0x0000024EB1646420, 16 bytes long.
 Data: <x#c&#177;N           > 78 23 63 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{277} normal block at 0x0000024EB1641C60, 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 0x0000024EB1646E70, 16 bytes long.
 Data: <P#c&#177;N           > 50 23 63 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{275} normal block at 0x0000024EB1632350, 320 bytes long.
 Data: <pnd&#177;N   ` d&#177;N   > 70 6E 64 B1 4E 02 00 00 60 1C 64 B1 4E 02 00 00 
{274} normal block at 0x0000024EB1646FB0, 16 bytes long.
 Data: <Psd&#177;N           > 50 73 64 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{273} normal block at 0x0000024EB1646650, 16 bytes long.
 Data: <(sd&#177;N           > 28 73 64 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{272} normal block at 0x0000024EB16423E0, 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 0x0000024EB1646600, 16 bytes long.
 Data: < sd&#177;N           > 00 73 64 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x0000024EB16421A0, 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 0x0000024EB1646D80, 16 bytes long.
 Data: <Hrd&#177;N           > 48 72 64 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x0000024EB16463D0, 16 bytes long.
 Data: < rd&#177;N           > 20 72 64 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{267} normal block at 0x0000024EB1646BA0, 16 bytes long.
 Data: <&#248;qd&#177;N           > F8 71 64 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{266} normal block at 0x0000024EB16462E0, 16 bytes long.
 Data: <&#208;qd&#177;N           > D0 71 64 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{265} normal block at 0x0000024EB1646740, 16 bytes long.
 Data: <&#168;qd&#177;N           > A8 71 64 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{264} normal block at 0x0000024EB16464C0, 16 bytes long.
 Data: < qd&#177;N           > 80 71 64 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{262} normal block at 0x0000024EB1646B50, 16 bytes long.
 Data: < Zd&#177;N           > 20 5A 64 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{261} normal block at 0x0000024EB1645A20, 40 bytes long.
 Data: <Pkd&#177;N   &#240;p3&#179;N   > 50 6B 64 B1 4E 02 00 00 F0 70 33 B3 4E 02 00 00 
{260} normal block at 0x0000024EB1646C90, 16 bytes long.
 Data: <`qd&#177;N           > 60 71 64 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{259} normal block at 0x0000024EB1646B00, 16 bytes long.
 Data: <8qd&#177;N           > 38 71 64 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{258} normal block at 0x0000024EB1641A20, 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 0x0000024EB1646AB0, 16 bytes long.
 Data: < qd&#177;N           > 10 71 64 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{256} normal block at 0x0000024EB1647110, 992 bytes long.
 Data: <&#176;jd&#177;N     d&#177;N   > B0 6A 64 B1 4E 02 00 00 20 1A 64 B1 4E 02 00 00 
{92} normal block at 0x0000024EB1641C00, 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 0x0000024EB163E770, 16 bytes long.
 Data: <P&#199;b&#177;N           > 50 C7 62 B1 4E 02 00 00 00 00 00 00 00 00 00 00 
{90} normal block at 0x0000024EB162C750, 40 bytes long.
 Data: <p&#231;c&#177;N     d&#177;N   > 70 E7 63 B1 4E 02 00 00 00 1C 64 B1 4E 02 00 00 
{69} normal block at 0x0000024EB163E220, 16 bytes long.
 Data: < &#234;B>&#246;           > 80 EA 42 3E F6 7F 00 00 00 00 00 00 00 00 00 00 
{68} normal block at 0x0000024EB163E860, 16 bytes long.
 Data: <@&#233;B>&#246;           > 40 E9 42 3E F6 7F 00 00 00 00 00 00 00 00 00 00 
{67} normal block at 0x0000024EB163E540, 16 bytes long.
 Data: <&#248;W?>&#246;           > F8 57 3F 3E F6 7F 00 00 00 00 00 00 00 00 00 00 
{66} normal block at 0x0000024EB163E400, 16 bytes long.
 Data: <&#216;W?>&#246;           > D8 57 3F 3E F6 7F 00 00 00 00 00 00 00 00 00 00 
{65} normal block at 0x0000024EB163E4F0, 16 bytes long.
 Data: <P ?>&#246;           > 50 04 3F 3E F6 7F 00 00 00 00 00 00 00 00 00 00 
{64} normal block at 0x0000024EB163EB80, 16 bytes long.
 Data: <0 ?>&#246;           > 30 04 3F 3E F6 7F 00 00 00 00 00 00 00 00 00 00 
{63} normal block at 0x0000024EB163E6D0, 16 bytes long.
 Data: <&#224; ?>&#246;           > E0 02 3F 3E F6 7F 00 00 00 00 00 00 00 00 00 00 
{62} normal block at 0x0000024EB163E130, 16 bytes long.
 Data: <  ?>&#246;           > 10 04 3F 3E F6 7F 00 00 00 00 00 00 00 00 00 00 
{61} normal block at 0x0000024EB163E680, 16 bytes long.
 Data: <p ?>&#246;           > 70 04 3F 3E F6 7F 00 00 00 00 00 00 00 00 00 00 
{60} normal block at 0x0000024EB163E4A0, 16 bytes long.
 Data: < &#192;=>&#246;           > 18 C0 3D 3E F6 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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