Task 38608460
| Name | CDK2_A03_A04_r0_2-QUICO_ATM_GAFF2_NAGL_CDK2-1-6-RND8505_0 |
| Workunit | 31561768 |
| Created | 14 Apr 2026, 16:21:28 UTC |
| Sent | 14 Apr 2026, 16:21:34 UTC |
| Report deadline | 19 Apr 2026, 16:21:34 UTC |
| Received | 21 Apr 2026, 22:17:00 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 195 (0x000000C3) EXIT_CHILD_FAILED |
| Computer ID | 627736 |
| Run time | 13 hours 31 min 12 sec |
| CPU time | 13 hours 31 min 12 sec |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 2,261.58 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 783.59 MB |
| Peak swap size | 9.82 GB |
| Peak disk usage | 3.13 GB |
Stderr output
<core_client_version>8.2.4</core_client_version>
<![CDATA[
<message>
The operating system cannot run .
(0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
12:00:45 (37664): wrapper (7.9.26016): starting
12:00:45 (37664): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A03_A04_0.pdb
QB_A03_A04_0.xml
QB_A03_A04.inpcrd
QB_A03_A04_input.yaml
QB_A03_A04.pdb
QB_A03_A04.prmtop
QB_A03_A04_sys.xml
run.bat
run.sh
12:00:47 (37664): Library/usr/bin/tar.exe exited; CPU time 0.000000
12:00:47 (37664): 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\1\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\1\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.
02:29:22 (37664): C:/Windows/system32/cmd.exe exited; CPU time 53046.140625
02:29:22 (37664): app exit status: 0x16
02:29:22 (37664): 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: 1076543845 bytes.
Dumping objects ->
{3835186} normal block at 0x000001F81E2FC900, 48 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835175} normal block at 0x000001F81E2FD230, 48 bytes long.
Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835164} normal block at 0x000001F81E2FC740, 48 bytes long.
Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61
{3835153} normal block at 0x000001F81C614180, 48 bytes long.
Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835142} normal block at 0x000001F81C614110, 48 bytes long.
Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61
{3835111} normal block at 0x000001F81E345B80, 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) : {3835098} normal block at 0x000001F81C60D550, 8 bytes long.
Data: < Ÿ ø > 00 00 9F 1C F8 01 00 00
{3833959} normal block at 0x000001F81C60D500, 8 bytes long.
Data: < K: ø > 00 4B 3A 1E F8 01 00 00
..\zip\boinc_zip.cpp(122) : {311} normal block at 0x000001F81C602220, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{296} normal block at 0x000001F81C5FF010, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
{295} normal block at 0x000001F81C614DA0, 16 bytes long.
Data: < _a ø > 98 5F 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{294} normal block at 0x000001F81C615250, 16 bytes long.
Data: <p_a ø > 70 5F 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{293} normal block at 0x000001F81C610E40, 32 bytes long.
Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D
{292} normal block at 0x000001F81C6151B0, 16 bytes long.
Data: <H_a ø > 48 5F 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{291} normal block at 0x000001F81C614FD0, 16 bytes long.
Data: < _a ø > 20 5F 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{290} normal block at 0x000001F81C615430, 16 bytes long.
Data: <ø^a ø > F8 5E 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x000001F81C6150C0, 16 bytes long.
Data: <Ð^a ø > D0 5E 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{288} normal block at 0x000001F81C614420, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{287} normal block at 0x000001F81C614F30, 16 bytes long.
Data: <hü_ ø > 68 FC 5F 1C F8 01 00 00 00 00 00 00 00 00 00 00
{286} normal block at 0x000001F81C610D80, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{285} normal block at 0x000001F81C614D50, 16 bytes long.
Data: <@ü_ ø > 40 FC 5F 1C F8 01 00 00 00 00 00 00 00 00 00 00
{283} normal block at 0x000001F81C615480, 16 bytes long.
Data: < ü_ ø > 18 FC 5F 1C F8 01 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x000001F81C614F80, 16 bytes long.
Data: <ðû_ ø > F0 FB 5F 1C F8 01 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x000001F81C614D00, 16 bytes long.
Data: <Èû_ ø > C8 FB 5F 1C F8 01 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x000001F81C615160, 16 bytes long.
Data: < û_ ø > A0 FB 5F 1C F8 01 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x000001F81C615BB0, 16 bytes long.
Data: <xû_ ø > 78 FB 5F 1C F8 01 00 00 00 00 00 00 00 00 00 00
{278} normal block at 0x000001F81C610D20, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{277} normal block at 0x000001F81C615390, 16 bytes long.
Data: <Pû_ ø > 50 FB 5F 1C F8 01 00 00 00 00 00 00 00 00 00 00
{276} normal block at 0x000001F81C5FFB50, 320 bytes long.
Data: < Sa ø a ø > 90 53 61 1C F8 01 00 00 20 0D 61 1C F8 01 00 00
{275} normal block at 0x000001F81C6159D0, 16 bytes long.
Data: <°^a ø > B0 5E 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{274} normal block at 0x000001F81C6158E0, 16 bytes long.
Data: < ^a ø > 88 5E 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{273} normal block at 0x000001F81C610CC0, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{272} normal block at 0x000001F81C6152A0, 16 bytes long.
Data: <`^a ø > 60 5E 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{271} normal block at 0x000001F81C610480, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{270} normal block at 0x000001F81C615B60, 16 bytes long.
Data: <¨]a ø > A8 5D 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{269} normal block at 0x000001F81C615200, 16 bytes long.
Data: < ]a ø > 80 5D 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{268} normal block at 0x000001F81C614E40, 16 bytes long.
Data: <X]a ø > 58 5D 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x000001F81C6153E0, 16 bytes long.
Data: <0]a ø > 30 5D 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x000001F81C615700, 16 bytes long.
Data: < ]a ø > 08 5D 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{265} normal block at 0x000001F81C615340, 16 bytes long.
Data: <à\a ø > E0 5C 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{263} normal block at 0x000001F81C615070, 16 bytes long.
Data: <°Ca ø > B0 43 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{262} normal block at 0x000001F81C6143B0, 40 bytes long.
Data: <pPa ø [4 ø > 70 50 61 1C F8 01 00 00 80 5B 34 1E F8 01 00 00
{261} normal block at 0x000001F81C614EE0, 16 bytes long.
Data: <À\a ø > C0 5C 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{260} normal block at 0x000001F81C614CB0, 16 bytes long.
Data: < \a ø > 98 5C 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{259} normal block at 0x000001F81C6104E0, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{258} normal block at 0x000001F81C614E90, 16 bytes long.
Data: <p\a ø > 70 5C 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{257} normal block at 0x000001F81C615C70, 992 bytes long.
Data: < Na ø à a ø > 90 4E 61 1C F8 01 00 00 E0 04 61 1C F8 01 00 00
{93} normal block at 0x000001F81C6102A0, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{92} normal block at 0x000001F81C60D0F0, 16 bytes long.
Data: <ðAa ø > F0 41 61 1C F8 01 00 00 00 00 00 00 00 00 00 00
{91} normal block at 0x000001F81C6141F0, 40 bytes long.
Data: <ðÐ` ø   a ø > F0 D0 60 1C F8 01 00 00 A0 02 61 1C F8 01 00 00
{70} normal block at 0x000001F81C60D4B0, 16 bytes long.
Data: < ê¤òö > 80 EA A4 F2 F6 7F 00 00 00 00 00 00 00 00 00 00
{69} normal block at 0x000001F81C60D460, 16 bytes long.
Data: <@é¤òö > 40 E9 A4 F2 F6 7F 00 00 00 00 00 00 00 00 00 00
{68} normal block at 0x000001F81C60D7D0, 16 bytes long.
Data: <øW¡òö > F8 57 A1 F2 F6 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x000001F81C60CBA0, 16 bytes long.
Data: <ØW¡òö > D8 57 A1 F2 F6 7F 00 00 00 00 00 00 00 00 00 00
{66} normal block at 0x000001F81C60C9C0, 16 bytes long.
Data: <P ¡òö > 50 04 A1 F2 F6 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x000001F81C60CD80, 16 bytes long.
Data: <0 ¡òö > 30 04 A1 F2 F6 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x000001F81C60D230, 16 bytes long.
Data: <à ¡òö > E0 02 A1 F2 F6 7F 00 00 00 00 00 00 00 00 00 00
{63} normal block at 0x000001F81C60D730, 16 bytes long.
Data: < ¡òö > 10 04 A1 F2 F6 7F 00 00 00 00 00 00 00 00 00 00
{62} normal block at 0x000001F81C60C970, 16 bytes long.
Data: <p ¡òö > 70 04 A1 F2 F6 7F 00 00 00 00 00 00 00 00 00 00
{61} normal block at 0x000001F81C60CA10, 16 bytes long.
Data: < ÀŸòö > 18 C0 9F F2 F6 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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