Task 38581235
| Name | PFKFB3_A28_A37_r0_1-QUICO_ATM_GAFF2_LOMAP_PFKFB3-0-5-RND5277_0 |
| Workunit | 31545761 |
| Created | 12 Dec 2025, 10:40:13 UTC |
| Sent | 12 Dec 2025, 10:40:16 UTC |
| Report deadline | 17 Dec 2025, 10:40:16 UTC |
| Received | 12 Dec 2025, 11:36:07 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 195 (0x000000C3) EXIT_CHILD_FAILED |
| Computer ID | 646868 |
| Run time | 34 min 28 sec |
| CPU time | 2 min 39 sec |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 12,746.04 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 51.74 MB |
| Peak swap size | 37.76 MB |
| Peak disk usage | 2.82 GB |
Stderr output
<core_client_version>8.2.4</core_client_version>
<![CDATA[
<message>
���������� ������� �� ����� �������� (null).
(0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
14:02:24 (29992): wrapper (7.9.26016): starting
14:02:24 (29992): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A28_A37_0.pdb
QB_A28_A37_0.xml
QB_A28_A37_equil.pdb
QB_A28_A37.inpcrd
QB_A28_A37_input.yaml
QB_A28_A37_mdlambda.pdb
QB_A28_A37_min.pdb
QB_A28_A37_npt.pdb
QB_A28_A37.pdb
QB_A28_A37.prmtop
QB_A28_A37_sys.xml
QB_A28_A37_therm.pdb
run.bat
run.sh
14:02:26 (29992): Library/usr/bin/tar.exe exited; CPU time 157.968750
14:02:26 (29992): 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 'ConnectTimeoutError(<pip._vendor.urllib3.connection.HTTPSConnection object at 0x000001D939949190>, 'Connection to 127.0.0.1 timed out. (connect timeout=15)')': /simple/pyaml/
WARNING: Retrying (Retry(total=3, connect=None, read=None, redirect=None, status=None)) after connection broken by 'ConnectTimeoutError(<pip._vendor.urllib3.connection.HTTPSConnection object at 0x000001D93DFBD810>, 'Connection to 127.0.0.1 timed out. (connect timeout=15)')': /simple/pyaml/
WARNING: Retrying (Retry(total=2, connect=None, read=None, redirect=None, status=None)) after connection broken by 'ConnectTimeoutError(<pip._vendor.urllib3.connection.HTTPSConnection object at 0x000001D93DFD0490>, 'Connection to 127.0.0.1 timed out. (connect timeout=15)')': /simple/pyaml/
WARNING: Retrying (Retry(total=1, connect=None, read=None, redirect=None, status=None)) after connection broken by 'ConnectTimeoutError(<pip._vendor.urllib3.connection.HTTPSConnection object at 0x000001D93DFD0590>, 'Connection to 127.0.0.1 timed out. (connect timeout=15)')': /simple/pyaml/
WARNING: Retrying (Retry(total=0, connect=None, read=None, redirect=None, status=None)) after connection broken by 'ConnectTimeoutError(<pip._vendor.urllib3.connection.HTTPSConnection object at 0x000001D93DFD0510>, 'Connection to 127.0.0.1 timed out. (connect timeout=15)')': /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 'ProxyError('Cannot connect to proxy.', NewConnectionError('<pip._vendor.urllib3.connection.HTTPSConnection object at 0x000001D042328CD0>: Failed to establish a new connection: [WinError 10013] Ñäåëàíà ïîïûòêà äîñòóïà ê ñîêåòó ìåòîäîì, çàïðåùåííûì ïðàâàìè äîñòóïà'))': /simple/atom-openmm/
WARNING: Retrying (Retry(total=3, connect=None, read=None, redirect=None, status=None)) after connection broken by 'ProxyError('Cannot connect to proxy.', NewConnectionError('<pip._vendor.urllib3.connection.HTTPSConnection object at 0x000001D042329D50>: Failed to establish a new connection: [WinError 10013] Ñäåëàíà ïîïûòêà äîñòóïà ê ñîêåòó ìåòîäîì, çàïðåùåííûì ïðàâàìè äîñòóïà'))': /simple/atom-openmm/
WARNING: Retrying (Retry(total=2, connect=None, read=None, redirect=None, status=None)) after connection broken by 'ProxyError('Cannot connect to proxy.', NewConnectionError('<pip._vendor.urllib3.connection.HTTPSConnection object at 0x000001D04232A610>: Failed to establish a new connection: [WinError 10013] Ñäåëàíà ïîïûòêà äîñòóïà ê ñîêåòó ìåòîäîì, çàïðåùåííûì ïðàâàìè äîñòóïà'))': /simple/atom-openmm/
WARNING: Retrying (Retry(total=1, connect=None, read=None, redirect=None, status=None)) after connection broken by 'ProxyError('Cannot connect to proxy.', NewConnectionError('<pip._vendor.urllib3.connection.HTTPSConnection object at 0x000001D04232AE50>: Failed to establish a new connection: [WinError 10013] Ñäåëàíà ïîïûòêà äîñòóïà ê ñîêåòó ìåòîäîì, çàïðåùåííûì ïðàâàìè äîñòóïà'))': /simple/atom-openmm/
WARNING: Retrying (Retry(total=0, connect=None, read=None, redirect=None, status=None)) after connection broken by 'ProxyError('Cannot connect to proxy.', NewConnectionError('<pip._vendor.urllib3.connection.HTTPSConnection object at 0x000001D04232B350>: Failed to establish a new connection: [WinError 10013] Ñäåëàíà ïîïûòêà äîñòóïà ê ñîêåòó ìåòîäîì, çàïðåùåííûì ïðàâàìè äîñòóïà'))': /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 'E:\\ProgramData\\BOINC\\slots\\0\\Scripts\\rbfe_production.exe': [Errno 2] No such file or directory
14:34:06 (29992): C:/Windows/system32/cmd.exe exited; CPU time 1.609375
14:34:06 (29992): app exit status: 0x16
14:34:06 (29992): 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: 21756177 bytes.
Dumping objects ->
{3835201} normal block at 0x000002173D59F0F0, 48 bytes long.
Data: <PATH=E:\ProgramD> 50 41 54 48 3D 45 3A 5C 50 72 6F 67 72 61 6D 44
{3835190} normal block at 0x000002173D59E910, 48 bytes long.
Data: <HOME=E:\ProgramD> 48 4F 4D 45 3D 45 3A 5C 50 72 6F 67 72 61 6D 44
{3835179} normal block at 0x000002173D59E750, 48 bytes long.
Data: <TMP=E:\ProgramDa> 54 4D 50 3D 45 3A 5C 50 72 6F 67 72 61 6D 44 61
{3835168} normal block at 0x000002173B7C6D80, 48 bytes long.
Data: <TEMP=E:\ProgramD> 54 45 4D 50 3D 45 3A 5C 50 72 6F 67 72 61 6D 44
{3835157} normal block at 0x000002173B7C6CA0, 48 bytes long.
Data: <TMPDIR=E:\Progra> 54 4D 50 44 49 52 3D 45 3A 5C 50 72 6F 67 72 61
{3835126} normal block at 0x000002173D5EB5B0, 64 bytes long.
Data: <PATH=E:\ProgramD> 50 41 54 48 3D 45 3A 5C 50 72 6F 67 72 61 6D 44
..\api\boinc_api.cpp(309) : {3835113} normal block at 0x000002173B7BC4D0, 8 bytes long.
Data: < (= > 00 00 28 3D 17 02 00 00
{3833957} normal block at 0x000002173B7BC8E0, 8 bytes long.
Data: <@}d= > 40 7D 64 3D 17 02 00 00
..\zip\boinc_zip.cpp(122) : {310} normal block at 0x000002173B7B3F10, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
{295} normal block at 0x000002173B7B6630, 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 0x000002173B7C8EE0, 16 bytes long.
Data: < –|; > 88 96 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{293} normal block at 0x000002173B7C8E90, 16 bytes long.
Data: <`–|; > 60 96 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x000002173B7C1F50, 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 0x000002173B7C8B70, 16 bytes long.
Data: <8–|; > 38 96 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{290} normal block at 0x000002173B7C9110, 16 bytes long.
Data: < –|; > 10 96 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x000002173B7C8DA0, 16 bytes long.
Data: <è•|; > E8 95 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{288} normal block at 0x000002173B7C9200, 16 bytes long.
Data: <À•|; > C0 95 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x000002173B7C6A00, 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 0x000002173B7C8FD0, 16 bytes long.
Data: < æz; > 98 E6 7A 3B 17 02 00 00 00 00 00 00 00 00 00 00
{285} normal block at 0x000002173B7C2970, 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 0x000002173B7C8B20, 16 bytes long.
Data: <pæz; > 70 E6 7A 3B 17 02 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x000002173B7C8990, 16 bytes long.
Data: <Hæz; > 48 E6 7A 3B 17 02 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x000002173B7C8D50, 16 bytes long.
Data: < æz; > 20 E6 7A 3B 17 02 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x000002173B7C88F0, 16 bytes long.
Data: <øåz; > F8 E5 7A 3B 17 02 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x000002173B7C8C60, 16 bytes long.
Data: <Ðåz; > D0 E5 7A 3B 17 02 00 00 00 00 00 00 00 00 00 00
{278} normal block at 0x000002173B7C8620, 16 bytes long.
Data: <¨åz; > A8 E5 7A 3B 17 02 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x000002173B7C2730, 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 0x000002173B7C8DF0, 16 bytes long.
Data: <یz; > 80 E5 7A 3B 17 02 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x000002173B7AE580, 320 bytes long.
Data: <ð|; 0'|; > F0 8D 7C 3B 17 02 00 00 30 27 7C 3B 17 02 00 00
{274} normal block at 0x000002173B7C8850, 16 bytes long.
Data: < •|; > A0 95 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{273} normal block at 0x000002173B7C87B0, 16 bytes long.
Data: <x•|; > 78 95 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{272} normal block at 0x000002173B7C26D0, 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 0x000002173B7C8580, 16 bytes long.
Data: <P•|; > 50 95 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{270} normal block at 0x000002173B7C1D10, 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 0x000002173B7C90C0, 16 bytes long.
Data: < ”|; > 98 94 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{268} normal block at 0x000002173B7C92F0, 16 bytes long.
Data: <p”|; > 70 94 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x000002173B7C9070, 16 bytes long.
Data: <H”|; > 48 94 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x000002173B7C8440, 16 bytes long.
Data: < ”|; > 20 94 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{265} normal block at 0x000002173B7C91B0, 16 bytes long.
Data: <ø“|; > F8 93 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{264} normal block at 0x000002173B7C8AD0, 16 bytes long.
Data: <Г|; > D0 93 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{262} normal block at 0x000002173B7C8710, 16 bytes long.
Data: <ðm|; > F0 6D 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{261} normal block at 0x000002173B7C6DF0, 40 bytes long.
Data: < ‡|; °µ^= > 10 87 7C 3B 17 02 00 00 B0 B5 5E 3D 17 02 00 00
{260} normal block at 0x000002173B7C86C0, 16 bytes long.
Data: <°“|; > B0 93 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{259} normal block at 0x000002173B7C8E40, 16 bytes long.
Data: < “|; > 88 93 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{258} normal block at 0x000002173B7C2490, 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 0x000002173B7C8800, 16 bytes long.
Data: <`“|; > 60 93 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{256} normal block at 0x000002173B7C9360, 992 bytes long.
Data: < |; $|; > 00 88 7C 3B 17 02 00 00 90 24 7C 3B 17 02 00 00
{92} normal block at 0x000002173B7C2070, 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 0x000002173B7BC930, 16 bytes long.
Data: <i|; > 90 69 7C 3B 17 02 00 00 00 00 00 00 00 00 00 00
{90} normal block at 0x000002173B7C6990, 40 bytes long.
Data: <0É{; p |; > 30 C9 7B 3B 17 02 00 00 70 20 7C 3B 17 02 00 00
{69} normal block at 0x000002173B7BC2A0, 16 bytes long.
Data: <€ê§c÷ > 80 EA A7 63 F7 7F 00 00 00 00 00 00 00 00 00 00
{68} normal block at 0x000002173B7BCBB0, 16 bytes long.
Data: <@é§c÷ > 40 E9 A7 63 F7 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x000002173B7BCB10, 16 bytes long.
Data: <øW¤c÷ > F8 57 A4 63 F7 7F 00 00 00 00 00 00 00 00 00 00
{66} normal block at 0x000002173B7BC2F0, 16 bytes long.
Data: <ØW¤c÷ > D8 57 A4 63 F7 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x000002173B7BC700, 16 bytes long.
Data: <P ¤c÷ > 50 04 A4 63 F7 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x000002173B7BD100, 16 bytes long.
Data: <0 ¤c÷ > 30 04 A4 63 F7 7F 00 00 00 00 00 00 00 00 00 00
{63} normal block at 0x000002173B7BC890, 16 bytes long.
Data: <à ¤c÷ > E0 02 A4 63 F7 7F 00 00 00 00 00 00 00 00 00 00
{62} normal block at 0x000002173B7BC9D0, 16 bytes long.
Data: < ¤c÷ > 10 04 A4 63 F7 7F 00 00 00 00 00 00 00 00 00 00
{61} normal block at 0x000002173B7BC980, 16 bytes long.
Data: <p ¤c÷ > 70 04 A4 63 F7 7F 00 00 00 00 00 00 00 00 00 00
{60} normal block at 0x000002173B7BC840, 16 bytes long.
Data: < À¢c÷ > 18 C0 A2 63 F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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