Task 38612968
| Name | TYK2_A15_A01_r0_2-QUICO_ATM_OpenFF_TYK2-4-6-RND5713_0 |
| Workunit | 31565520 |
| Created | 16 Apr 2026, 14:14:01 UTC |
| Sent | 16 Apr 2026, 14:14:08 UTC |
| Report deadline | 21 Apr 2026, 14:14:08 UTC |
| Received | 16 Apr 2026, 16:00:18 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 195 (0x000000C3) EXIT_CHILD_FAILED |
| Computer ID | 619891 |
| Run time | 1 hours 21 min 47 sec |
| CPU time | 1 hours 12 min 39 sec |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 16,318.67 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 710.86 MB |
| Peak swap size | 11.31 GB |
| Peak disk usage | 3.02 GB |
Stderr output
<core_client_version>8.2.9</core_client_version>
<![CDATA[
<message>
The operating system cannot run .
(0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
08:17:36 (8704): wrapper (7.9.26016): starting
08:17:36 (8704): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A15_A01_0.pdb
QB_A15_A01_0.xml
QB_A15_A01.inpcrd
QB_A15_A01_input.yaml
QB_A15_A01.pdb
QB_A15_A01.prmtop
QB_A15_A01_sys.xml
run.bat
run.sh
08:17:39 (8704): Library/usr/bin/tar.exe exited; CPU time 0.000000
08:17:39 (8704): 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\10\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\10\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.
09:55:52 (8704): C:/Windows/system32/cmd.exe exited; CPU time 5291.171875
09:55:52 (8704): app exit status: 0x16
09:55:52 (8704): 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: 140243317 bytes.
Dumping objects ->
{3835290} normal block at 0x00000190C13179B0, 48 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835279} normal block at 0x00000190C1318190, 48 bytes long.
Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835268} normal block at 0x00000190C1317B70, 48 bytes long.
Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61
{3835257} normal block at 0x00000190BEBE68E0, 48 bytes long.
Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835246} normal block at 0x00000190BEBE66B0, 48 bytes long.
Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61
{3835215} normal block at 0x00000190C11C1250, 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) : {3835202} normal block at 0x00000190BEBDA080, 8 bytes long.
Data: < ·¾ > 00 00 B7 BE 90 01 00 00
{3833995} normal block at 0x00000190BEBD9900, 8 bytes long.
Data: <p‰4Á > 70 89 34 C1 90 01 00 00
..\zip\boinc_zip.cpp(122) : {329} normal block at 0x00000190BEBD1AE0, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{314} normal block at 0x00000190BEBDC460, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
{313} normal block at 0x00000190BEBE92A0, 16 bytes long.
Data: <H¤¾¾ > 48 A4 BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{312} normal block at 0x00000190BEBE9250, 16 bytes long.
Data: < ¤¾¾ > 20 A4 BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{311} normal block at 0x00000190BEBE3770, 32 bytes long.
Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D
{310} normal block at 0x00000190BEBE97A0, 16 bytes long.
Data: <ø£¾¾ > F8 A3 BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{309} normal block at 0x00000190BEBE91B0, 16 bytes long.
Data: <У¾¾ > D0 A3 BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{308} normal block at 0x00000190BEBE9700, 16 bytes long.
Data: <¨£¾¾ > A8 A3 BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{307} normal block at 0x00000190BEBE97F0, 16 bytes long.
Data: < £¾¾ > 80 A3 BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{306} normal block at 0x00000190BEBE6BF0, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{305} normal block at 0x00000190BEBE9AC0, 16 bytes long.
Data: <8/½¾ > 38 2F BD BE 90 01 00 00 00 00 00 00 00 00 00 00
{304} normal block at 0x00000190BEBE3470, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{303} normal block at 0x00000190BEBE9160, 16 bytes long.
Data: < /½¾ > 10 2F BD BE 90 01 00 00 00 00 00 00 00 00 00 00
{301} normal block at 0x00000190BEBE9660, 16 bytes long.
Data: <è.½¾ > E8 2E BD BE 90 01 00 00 00 00 00 00 00 00 00 00
{300} normal block at 0x00000190BEBE9DE0, 16 bytes long.
Data: <À.½¾ > C0 2E BD BE 90 01 00 00 00 00 00 00 00 00 00 00
{299} normal block at 0x00000190BEBE9A20, 16 bytes long.
Data: < .½¾ > 98 2E BD BE 90 01 00 00 00 00 00 00 00 00 00 00
{298} normal block at 0x00000190BEBE9610, 16 bytes long.
Data: <p.½¾ > 70 2E BD BE 90 01 00 00 00 00 00 00 00 00 00 00
{297} normal block at 0x00000190BEBE9430, 16 bytes long.
Data: <H.½¾ > 48 2E BD BE 90 01 00 00 00 00 00 00 00 00 00 00
{296} normal block at 0x00000190BEBE3530, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{295} normal block at 0x00000190BEBE9D40, 16 bytes long.
Data: < .½¾ > 20 2E BD BE 90 01 00 00 00 00 00 00 00 00 00 00
{294} normal block at 0x00000190BEBD2E20, 320 bytes long.
Data: <@ ¾¾ 05¾¾ > 40 9D BE BE 90 01 00 00 30 35 BE BE 90 01 00 00
{293} normal block at 0x00000190BEBE9340, 16 bytes long.
Data: <`£¾¾ > 60 A3 BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x00000190BEBE9C00, 16 bytes long.
Data: <8£¾¾ > 38 A3 BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{291} normal block at 0x00000190BEBE3C50, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{290} normal block at 0x00000190BEBE9110, 16 bytes long.
Data: < £¾¾ > 10 A3 BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x00000190BEBE3410, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{288} normal block at 0x00000190BEBE9070, 16 bytes long.
Data: <X¢¾¾ > 58 A2 BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x00000190BEBE9B10, 16 bytes long.
Data: <0¢¾¾ > 30 A2 BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{286} normal block at 0x00000190BEBE9200, 16 bytes long.
Data: < ¢¾¾ > 08 A2 BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{285} normal block at 0x00000190BEBE95C0, 16 bytes long.
Data: <ࡾ¾ > E0 A1 BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{284} normal block at 0x00000190BEBE9020, 16 bytes long.
Data: <¸¡¾¾ > B8 A1 BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{283} normal block at 0x00000190BEBE9570, 16 bytes long.
Data: < ¡¾¾ > 90 A1 BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x00000190BEBE9520, 16 bytes long.
Data: < k¾¾ > 10 6B BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x00000190BEBE6B10, 40 bytes long.
Data: < •¾¾ P Á > 20 95 BE BE 90 01 00 00 50 12 1C C1 90 01 00 00
{279} normal block at 0x00000190BEBE8F30, 16 bytes long.
Data: <p¡¾¾ > 70 A1 BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{278} normal block at 0x00000190BEBE99D0, 16 bytes long.
Data: <H¡¾¾ > 48 A1 BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x00000190BEBE3590, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{276} normal block at 0x00000190BEBE9980, 16 bytes long.
Data: < ¡¾¾ > 20 A1 BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x00000190BEBEA120, 992 bytes long.
Data: < ¾¾ 5¾¾ > 80 99 BE BE 90 01 00 00 90 35 BE BE 90 01 00 00
{111} normal block at 0x00000190BEBE2F30, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{110} normal block at 0x00000190BEBD9950, 16 bytes long.
Data: < h¾¾ > 00 68 BE BE 90 01 00 00 00 00 00 00 00 00 00 00
{109} normal block at 0x00000190BEBE6800, 40 bytes long.
Data: <P ½¾ 0/¾¾ > 50 99 BD BE 90 01 00 00 30 2F BE BE 90 01 00 00
{88} normal block at 0x00000190BEBD9860, 16 bytes long.
Data: < êI ö > 80 EA 49 0A F6 7F 00 00 00 00 00 00 00 00 00 00
{87} normal block at 0x00000190BEBD9810, 16 bytes long.
Data: <@éI ö > 40 E9 49 0A F6 7F 00 00 00 00 00 00 00 00 00 00
{86} normal block at 0x00000190BEBD9EF0, 16 bytes long.
Data: <øWF ö > F8 57 46 0A F6 7F 00 00 00 00 00 00 00 00 00 00
{85} normal block at 0x00000190BEBD97C0, 16 bytes long.
Data: <ØWF ö > D8 57 46 0A F6 7F 00 00 00 00 00 00 00 00 00 00
{84} normal block at 0x00000190BEBDA670, 16 bytes long.
Data: <P F ö > 50 04 46 0A F6 7F 00 00 00 00 00 00 00 00 00 00
{83} normal block at 0x00000190BEBDA620, 16 bytes long.
Data: <0 F ö > 30 04 46 0A F6 7F 00 00 00 00 00 00 00 00 00 00
{82} normal block at 0x00000190BEBD9EA0, 16 bytes long.
Data: <à F ö > E0 02 46 0A F6 7F 00 00 00 00 00 00 00 00 00 00
{81} normal block at 0x00000190BEBD9E00, 16 bytes long.
Data: < F ö > 10 04 46 0A F6 7F 00 00 00 00 00 00 00 00 00 00
{80} normal block at 0x00000190BEBD9DB0, 16 bytes long.
Data: <p F ö > 70 04 46 0A F6 7F 00 00 00 00 00 00 00 00 00 00
{79} normal block at 0x00000190BEBD9E50, 16 bytes long.
Data: < ÀD ö > 18 C0 44 0A F6 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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