Task 38581605
| Name | JNK1_A19_A12_r0_1-QUICO_ATM_GAFF2_LOMAP_JNK1_3-2-5-RND4114_0 |
| Workunit | 31546105 |
| Created | 12 Dec 2025, 11:11:10 UTC |
| Sent | 12 Dec 2025, 11:11:22 UTC |
| Report deadline | 17 Dec 2025, 11:11:22 UTC |
| Received | 12 Dec 2025, 11:18:15 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 195 (0x000000C3) EXIT_CHILD_FAILED |
| Computer ID | 646119 |
| Run time | 2 min 59 sec |
| CPU time | 3 sec |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 4,379.88 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 51.94 MB |
| Peak swap size | 39.31 MB |
| Peak disk usage | 2.08 GB |
Stderr output
<core_client_version>8.2.4</core_client_version>
<![CDATA[
<message>
(null) nelze spustit.
(0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
12:15:19 (1165708): wrapper (7.9.26016): starting
12:15:19 (1165708): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A19_A12_0.pdb
QB_A19_A12_0.xml
QB_A19_A12_equil.pdb
QB_A19_A12.inpcrd
QB_A19_A12_input.yaml
QB_A19_A12_mdlambda.pdb
QB_A19_A12_min.pdb
QB_A19_A12_npt.pdb
QB_A19_A12_out_merged_nowater.pdb
QB_A19_A12.pdb
QB_A19_A12.prmtop
QB_A19_A12_sys.xml
QB_A19_A12_therm.pdb
run.bat
run.sh
12:15:23 (1165708): Library/usr/bin/tar.exe exited; CPU time 0.265625
12:15:23 (1165708): 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 0x00000123C0893850>: Failed to establish a new connection: [WinError 10013] Došlo k pokusu o pøístup k soketu zpùsobem zakázaným jeho pøístupovými oprávnìními')': /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 0x00000123C0894510>: Failed to establish a new connection: [WinError 10013] Došlo k pokusu o pøístup k soketu zpùsobem zakázaným jeho pøístupovými oprávnìními')': /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 0x00000123C0894C10>: Failed to establish a new connection: [WinError 10013] Došlo k pokusu o pøístup k soketu zpùsobem zakázaným jeho pøístupovými oprávnìními')': /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 0x00000123C0895490>: Failed to establish a new connection: [WinError 10013] Došlo k pokusu o pøístup k soketu zpùsobem zakázaným jeho pøístupovými oprávnìními')': /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 0x00000123C0895F90>: Failed to establish a new connection: [WinError 10013] Došlo k pokusu o pøístup k soketu zpùsobem zakázaným jeho pøístupovými oprávnìními')': /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 0x000001D9D64F0B10>: Failed to establish a new connection: [WinError 10013] Došlo k pokusu o pøístup k soketu zpùsobem zakázaným jeho pøístupovými oprávnìními')': /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 0x000001D9D64F1B10>: Failed to establish a new connection: [WinError 10013] Došlo k pokusu o pøístup k soketu zpùsobem zakázaným jeho pøístupovými oprávnìními')': /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 0x000001D9D64F2550>: Failed to establish a new connection: [WinError 10013] Došlo k pokusu o pøístup k soketu zpùsobem zakázaným jeho pøístupovými oprávnìními')': /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 0x000001D9D64F3410>: Failed to establish a new connection: [WinError 10013] Došlo k pokusu o pøístup k soketu zpùsobem zakázaným jeho pøístupovými oprávnìními')': /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 0x000001D9D650C090>: Failed to establish a new connection: [WinError 10013] Došlo k pokusu o pøístup k soketu zpùsobem zakázaným jeho pøístupovými oprávnìními')': /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\\7\\Scripts\\rbfe_production.exe': [Errno 2] No such file or directory
12:16:12 (1165708): C:/Windows/system32/cmd.exe exited; CPU time 2.984375
12:16:12 (1165708): app exit status: 0x16
12:16:12 (1165708): 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: 1154517 bytes.
Dumping objects ->
{3835327} normal block at 0x0000016C655CCA40, 48 bytes long.
Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835316} normal block at 0x0000016C63834660, 48 bytes long.
Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835305} normal block at 0x0000016C638345F0, 48 bytes long.
Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61
{3835294} normal block at 0x0000016C63834510, 48 bytes long.
Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44
{3835283} normal block at 0x0000016C63834740, 48 bytes long.
Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61
{3835252} normal block at 0x0000016C65615E00, 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) : {3835239} normal block at 0x0000016C6382D080, 8 bytes long.
Data: < )el > 00 00 29 65 6C 01 00 00
{3833955} normal block at 0x0000016C6382D030, 8 bytes long.
Data: <àÔ cl > E0 D4 81 63 6C 01 00 00
..\zip\boinc_zip.cpp(122) : {309} normal block at 0x0000016C638209B0, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{294} normal block at 0x0000016C63821960, 80 bytes long.
Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C
{293} normal block at 0x0000016C63835CE0, 16 bytes long.
Data: < c cl > 98 63 83 63 6C 01 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x0000016C638354C0, 16 bytes long.
Data: <pc cl > 70 63 83 63 6C 01 00 00 00 00 00 00 00 00 00 00
{291} normal block at 0x0000016C63830CA0, 32 bytes long.
Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D
{290} normal block at 0x0000016C638359C0, 16 bytes long.
Data: <Hc cl > 48 63 83 63 6C 01 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x0000016C63835150, 16 bytes long.
Data: < c cl > 20 63 83 63 6C 01 00 00 00 00 00 00 00 00 00 00
{288} normal block at 0x0000016C63835470, 16 bytes long.
Data: <øb cl > F8 62 83 63 6C 01 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x0000016C638358D0, 16 bytes long.
Data: <Ðb cl > D0 62 83 63 6C 01 00 00 00 00 00 00 00 00 00 00
{286} normal block at 0x0000016C63834A50, 48 bytes long.
Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F
{285} normal block at 0x0000016C63835100, 16 bytes long.
Data: <¸ ‚cl > B8 04 82 63 6C 01 00 00 00 00 00 00 00 00 00 00
{284} normal block at 0x0000016C63830B80, 32 bytes long.
Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69
{283} normal block at 0x0000016C63835880, 16 bytes long.
Data: < ‚cl > 90 04 82 63 6C 01 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x0000016C638352E0, 16 bytes long.
Data: <h ‚cl > 68 04 82 63 6C 01 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x0000016C63835B50, 16 bytes long.
Data: <@ ‚cl > 40 04 82 63 6C 01 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x0000016C638356A0, 16 bytes long.
Data: < ‚cl > 18 04 82 63 6C 01 00 00 00 00 00 00 00 00 00 00
{278} normal block at 0x0000016C63835420, 16 bytes long.
Data: <ð ‚cl > F0 03 82 63 6C 01 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x0000016C63835380, 16 bytes long.
Data: <È ‚cl > C8 03 82 63 6C 01 00 00 00 00 00 00 00 00 00 00
{276} normal block at 0x0000016C63831300, 32 bytes long.
Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55
{275} normal block at 0x0000016C63835FB0, 16 bytes long.
Data: <  ‚cl > A0 03 82 63 6C 01 00 00 00 00 00 00 00 00 00 00
{274} normal block at 0x0000016C638203A0, 320 bytes long.
Data: <°_ cl cl > B0 5F 83 63 6C 01 00 00 00 13 83 63 6C 01 00 00
{273} normal block at 0x0000016C63835650, 16 bytes long.
Data: <°b cl > B0 62 83 63 6C 01 00 00 00 00 00 00 00 00 00 00
{272} normal block at 0x0000016C63835AB0, 16 bytes long.
Data: < b cl > 88 62 83 63 6C 01 00 00 00 00 00 00 00 00 00 00
{271} normal block at 0x0000016C63830EE0, 32 bytes long.
Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65
{270} normal block at 0x0000016C63835290, 16 bytes long.
Data: <`b cl > 60 62 83 63 6C 01 00 00 00 00 00 00 00 00 00 00
{269} normal block at 0x0000016C63830C40, 32 bytes long.
Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62
{268} normal block at 0x0000016C63835970, 16 bytes long.
Data: <¨a cl > A8 61 83 63 6C 01 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x0000016C63835830, 16 bytes long.
Data: < a cl > 80 61 83 63 6C 01 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x0000016C63835240, 16 bytes long.
Data: <Xa cl > 58 61 83 63 6C 01 00 00 00 00 00 00 00 00 00 00
{265} normal block at 0x0000016C63835F60, 16 bytes long.
Data: <0a cl > 30 61 83 63 6C 01 00 00 00 00 00 00 00 00 00 00
{264} normal block at 0x0000016C638356F0, 16 bytes long.
Data: < a cl > 08 61 83 63 6C 01 00 00 00 00 00 00 00 00 00 00
{263} normal block at 0x0000016C63835BA0, 16 bytes long.
Data: <à` cl > E0 60 83 63 6C 01 00 00 00 00 00 00 00 00 00 00
{261} normal block at 0x0000016C63835EC0, 16 bytes long.
Data: < H cl > 90 48 83 63 6C 01 00 00 00 00 00 00 00 00 00 00
{260} normal block at 0x0000016C63834890, 40 bytes long.
Data: <À^ cl ^ael > C0 5E 83 63 6C 01 00 00 00 5E 61 65 6C 01 00 00
{259} normal block at 0x0000016C638350B0, 16 bytes long.
Data: <À` cl > C0 60 83 63 6C 01 00 00 00 00 00 00 00 00 00 00
{258} normal block at 0x0000016C63835560, 16 bytes long.
Data: < ` cl > 98 60 83 63 6C 01 00 00 00 00 00 00 00 00 00 00
{257} normal block at 0x0000016C63830B20, 32 bytes long.
Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F
{256} normal block at 0x0000016C63835F10, 16 bytes long.
Data: <p` cl > 70 60 83 63 6C 01 00 00 00 00 00 00 00 00 00 00
{255} normal block at 0x0000016C63836070, 992 bytes long.
Data: < _ cl cl > 10 5F 83 63 6C 01 00 00 20 0B 83 63 6C 01 00 00
{91} normal block at 0x0000016C63830AC0, 32 bytes long.
Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F
{90} normal block at 0x0000016C6382D3A0, 16 bytes long.
Data: <PÄ cl > 50 C4 81 63 6C 01 00 00 00 00 00 00 00 00 00 00
{89} normal block at 0x0000016C6381C450, 40 bytes long.
Data: < Ó‚cl À cl > A0 D3 82 63 6C 01 00 00 C0 0A 83 63 6C 01 00 00
{68} normal block at 0x0000016C6382D940, 16 bytes long.
Data: < êP¦÷ > 80 EA 50 A6 F7 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x0000016C6382CE50, 16 bytes long.
Data: <@éP¦÷ > 40 E9 50 A6 F7 7F 00 00 00 00 00 00 00 00 00 00
{66} normal block at 0x0000016C6382CEF0, 16 bytes long.
Data: <øWM¦÷ > F8 57 4D A6 F7 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x0000016C6382D990, 16 bytes long.
Data: <ØWM¦÷ > D8 57 4D A6 F7 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x0000016C6382D7B0, 16 bytes long.
Data: <P M¦÷ > 50 04 4D A6 F7 7F 00 00 00 00 00 00 00 00 00 00
{63} normal block at 0x0000016C6382DA80, 16 bytes long.
Data: <0 M¦÷ > 30 04 4D A6 F7 7F 00 00 00 00 00 00 00 00 00 00
{62} normal block at 0x0000016C6382D260, 16 bytes long.
Data: <à M¦÷ > E0 02 4D A6 F7 7F 00 00 00 00 00 00 00 00 00 00
{61} normal block at 0x0000016C6382CFE0, 16 bytes long.
Data: < M¦÷ > 10 04 4D A6 F7 7F 00 00 00 00 00 00 00 00 00 00
{60} normal block at 0x0000016C6382D8A0, 16 bytes long.
Data: <p M¦÷ > 70 04 4D A6 F7 7F 00 00 00 00 00 00 00 00 00 00
{59} normal block at 0x0000016C6382D210, 16 bytes long.
Data: < ÀK¦÷ > 18 C0 4B A6 F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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