Task 38636239

Name PTP1B_A07_A17_r0_5-QUICO_ATM_OpenFF23_NAGL_PTP1B-4-6-RND4912_0
Workunit 31584514
Created 29 Apr 2026, 1:29:23 UTC
Sent 29 Apr 2026, 1:29:33 UTC
Report deadline 4 May 2026, 1:29:33 UTC
Received 30 Apr 2026, 1:29:48 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 652041
Run time 54 sec
CPU time
Validate state Invalid
Credit 0.00
Device peak FLOPS 43,951.24 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 49.28 MB
Peak swap size 38.09 MB
Peak disk usage 1.56 GB

Stderr output

<core_client_version>8.2.9</core_client_version>
<![CDATA[
<message>
The operating system cannot run (null).
 (0xc3) - exit code 195 (0xc3)</message>
<stderr_txt>
23:25:57 (7688): wrapper (7.9.26016): starting
23:25:57 (7688): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A07_A17_0.pdb
QB_A07_A17_0.xml
QB_A07_A17.inpcrd
QB_A07_A17_input.yaml
QB_A07_A17.pdb
QB_A07_A17.prmtop
QB_A07_A17_sys.xml
run.bat
run.sh
23:25:58 (7688): Library/usr/bin/tar.exe exited; CPU time 0.000000
23:25:58 (7688): 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 0x000001C6079EAC50>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /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 0x000001C6079F8850>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /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 0x000001C6079F91D0>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /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 0x000001C6079F9A50>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /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 0x000001C6079FA310>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /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 0x0000027EEF5DDE90>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /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 0x0000027EEF5DE990>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /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 0x0000027EEF5DF290>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /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 0x0000027EEF5DFE50>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /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 0x0000027EEF5ECA10>: Failed to establish a new connection: [Errno 11001] getaddrinfo failed')': /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 'T:\\BOINCData\\slots\\0\\Scripts\\rbfe_production.exe': [Errno 2] No such file or directory
23:26:21 (7688): C:/Windows/system32/cmd.exe exited; CPU time 0.312500
23:26:21 (7688): app exit status: 0x16
23:26:21 (7688): called boinc_finish(195)
0 bytes in 0 Free Blocks.
456 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: 459387 bytes.
Dumping objects ->
{3835206} normal block at 0x000001857224A280, 48 bytes long.
 Data: <PATH=T:\BOINCDat> 50 41 54 48 3D 54 3A 5C 42 4F 49 4E 43 44 61 74 
{3835195} normal block at 0x0000018573F55810, 32 bytes long.
 Data: <HOME=T:\BOINCDat> 48 4F 4D 45 3D 54 3A 5C 42 4F 49 4E 43 44 61 74 
{3835184} normal block at 0x0000018573F56050, 32 bytes long.
 Data: <TMP=T:\BOINCData> 54 4D 50 3D 54 3A 5C 42 4F 49 4E 43 44 61 74 61 
{3835173} normal block at 0x0000018573F56650, 32 bytes long.
 Data: <TEMP=T:\BOINCDat> 54 45 4D 50 3D 54 3A 5C 42 4F 49 4E 43 44 61 74 
{3835162} normal block at 0x0000018573F557B0, 32 bytes long.
 Data: <TMPDIR=T:\BOINCD> 54 4D 50 44 49 52 3D 54 3A 5C 42 4F 49 4E 43 44 
{3835131} normal block at 0x000001857224A520, 48 bytes long.
 Data: <PATH=T:\BOINCDat> 50 41 54 48 3D 54 3A 5C 42 4F 49 4E 43 44 61 74 
{3835120} normal block at 0x000001857229D610, 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) : {3835117} normal block at 0x00000185722453C0, 8 bytes long.
 Data: <   r&#133;   > 00 00 1B 72 85 01 00 00 
{3834522} normal block at 0x000001857229E240, 140 bytes long.
 Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65 
{3833941} normal block at 0x00000185722460E0, 8 bytes long.
 Data: < &#140;'r&#133;   > 10 8C 27 72 85 01 00 00 
..\zip\boinc_zip.cpp(122) : {302} normal block at 0x0000018572251610, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{287} normal block at 0x0000018572235AE0, 80 bytes long.
 Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C 
{286} normal block at 0x0000018572252A60, 16 bytes long.
 Data: <&#200;H%r&#133;           > C8 48 25 72 85 01 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x0000018572252970, 16 bytes long.
 Data: <&#160;H%r&#133;           > A0 48 25 72 85 01 00 00 00 00 00 00 00 00 00 00 
{284} normal block at 0x000001857224B3C0, 32 bytes long.
 Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D 
{283} normal block at 0x0000018572252E70, 16 bytes long.
 Data: <xH%r&#133;           > 78 48 25 72 85 01 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x0000018572252D30, 16 bytes long.
 Data: <PH%r&#133;           > 50 48 25 72 85 01 00 00 00 00 00 00 00 00 00 00 
{281} normal block at 0x0000018572253050, 16 bytes long.
 Data: <(H%r&#133;           > 28 48 25 72 85 01 00 00 00 00 00 00 00 00 00 00 
{280} normal block at 0x0000018572252920, 16 bytes long.
 Data: < H%r&#133;           > 00 48 25 72 85 01 00 00 00 00 00 00 00 00 00 00 
{279} normal block at 0x000001857224A590, 48 bytes long.
 Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F 
{278} normal block at 0x0000018572252A10, 16 bytes long.
 Data: <xZ#r&#133;           > 78 5A 23 72 85 01 00 00 00 00 00 00 00 00 00 00 
{277} normal block at 0x000001857224B840, 32 bytes long.
 Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69 
{276} normal block at 0x0000018572253190, 16 bytes long.
 Data: <PZ#r&#133;           > 50 5A 23 72 85 01 00 00 00 00 00 00 00 00 00 00 
{274} normal block at 0x0000018572253000, 16 bytes long.
 Data: <(Z#r&#133;           > 28 5A 23 72 85 01 00 00 00 00 00 00 00 00 00 00 
{273} normal block at 0x0000018572252B50, 16 bytes long.
 Data: < Z#r&#133;           > 00 5A 23 72 85 01 00 00 00 00 00 00 00 00 00 00 
{272} normal block at 0x0000018572252830, 16 bytes long.
 Data: <&#216;Y#r&#133;           > D8 59 23 72 85 01 00 00 00 00 00 00 00 00 00 00 
{271} normal block at 0x00000185722529C0, 16 bytes long.
 Data: <&#176;Y#r&#133;           > B0 59 23 72 85 01 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x0000018572252740, 16 bytes long.
 Data: < Y#r&#133;           > 88 59 23 72 85 01 00 00 00 00 00 00 00 00 00 00 
{269} normal block at 0x000001857224B7E0, 32 bytes long.
 Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55 
{268} normal block at 0x00000185722524C0, 16 bytes long.
 Data: <`Y#r&#133;           > 60 59 23 72 85 01 00 00 00 00 00 00 00 00 00 00 
{267} normal block at 0x0000018572235960, 320 bytes long.
 Data: <&#192;$%r&#133;   &#224;&#183;$r&#133;   > C0 24 25 72 85 01 00 00 E0 B7 24 72 85 01 00 00 
{266} normal block at 0x00000185722528D0, 16 bytes long.
 Data: <&#224;G%r&#133;           > E0 47 25 72 85 01 00 00 00 00 00 00 00 00 00 00 
{265} normal block at 0x00000185722526F0, 16 bytes long.
 Data: <&#184;G%r&#133;           > B8 47 25 72 85 01 00 00 00 00 00 00 00 00 00 00 
{264} normal block at 0x000001857224BA20, 32 bytes long.
 Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65 
{263} normal block at 0x0000018572253230, 16 bytes long.
 Data: < G%r&#133;           > 90 47 25 72 85 01 00 00 00 00 00 00 00 00 00 00 
{262} normal block at 0x000001857224B4E0, 32 bytes long.
 Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62 
{261} normal block at 0x00000185722526A0, 16 bytes long.
 Data: <&#216;F%r&#133;           > D8 46 25 72 85 01 00 00 00 00 00 00 00 00 00 00 
{260} normal block at 0x0000018572252420, 16 bytes long.
 Data: <&#176;F%r&#133;           > B0 46 25 72 85 01 00 00 00 00 00 00 00 00 00 00 
{259} normal block at 0x0000018572252BF0, 16 bytes long.
 Data: < F%r&#133;           > 88 46 25 72 85 01 00 00 00 00 00 00 00 00 00 00 
{258} normal block at 0x0000018572252CE0, 16 bytes long.
 Data: <`F%r&#133;           > 60 46 25 72 85 01 00 00 00 00 00 00 00 00 00 00 
{257} normal block at 0x0000018572252650, 16 bytes long.
 Data: <8F%r&#133;           > 38 46 25 72 85 01 00 00 00 00 00 00 00 00 00 00 
{256} normal block at 0x00000185722530F0, 16 bytes long.
 Data: < F%r&#133;           > 10 46 25 72 85 01 00 00 00 00 00 00 00 00 00 00 
{254} normal block at 0x0000018572253280, 16 bytes long.
 Data: < &#166;$r&#133;           > 00 A6 24 72 85 01 00 00 00 00 00 00 00 00 00 00 
{253} normal block at 0x000001857224A600, 40 bytes long.
 Data: < 2%r&#133;    &#165;$r&#133;   > 80 32 25 72 85 01 00 00 20 A5 24 72 85 01 00 00 
{252} normal block at 0x0000018572252C90, 16 bytes long.
 Data: <&#240;E%r&#133;           > F0 45 25 72 85 01 00 00 00 00 00 00 00 00 00 00 
{251} normal block at 0x0000018572252600, 16 bytes long.
 Data: <&#200;E%r&#133;           > C8 45 25 72 85 01 00 00 00 00 00 00 00 00 00 00 
{250} normal block at 0x000001857224BF60, 32 bytes long.
 Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F 
{249} normal block at 0x0000018572253140, 16 bytes long.
 Data: <&#160;E%r&#133;           > A0 45 25 72 85 01 00 00 00 00 00 00 00 00 00 00 
{248} normal block at 0x00000185722545A0, 992 bytes long.
 Data: <@1%r&#133;   `&#191;$r&#133;   > 40 31 25 72 85 01 00 00 60 BF 24 72 85 01 00 00 
{84} normal block at 0x000001857224B720, 32 bytes long.
 Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F 
{83} normal block at 0x0000018572245820, 16 bytes long.
 Data: <&#208;&#163;$r&#133;           > D0 A3 24 72 85 01 00 00 00 00 00 00 00 00 00 00 
{82} normal block at 0x000001857224A3D0, 40 bytes long.
 Data: < X$r&#133;    &#183;$r&#133;   > 20 58 24 72 85 01 00 00 20 B7 24 72 85 01 00 00 
{61} normal block at 0x0000018572246090, 16 bytes long.
 Data: < &#234;&#252; &#247;           > 80 EA FC 8F F7 7F 00 00 00 00 00 00 00 00 00 00 
{60} normal block at 0x0000018572245730, 16 bytes long.
 Data: <@&#233;&#252; &#247;           > 40 E9 FC 8F F7 7F 00 00 00 00 00 00 00 00 00 00 
{59} normal block at 0x0000018572245690, 16 bytes long.
 Data: <&#248;W&#249; &#247;           > F8 57 F9 8F F7 7F 00 00 00 00 00 00 00 00 00 00 
{58} normal block at 0x0000018572245E60, 16 bytes long.
 Data: <&#216;W&#249; &#247;           > D8 57 F9 8F F7 7F 00 00 00 00 00 00 00 00 00 00 
{57} normal block at 0x0000018572245910, 16 bytes long.
 Data: <P &#249; &#247;           > 50 04 F9 8F F7 7F 00 00 00 00 00 00 00 00 00 00 
{56} normal block at 0x00000185722451E0, 16 bytes long.
 Data: <0 &#249; &#247;           > 30 04 F9 8F F7 7F 00 00 00 00 00 00 00 00 00 00 
{55} normal block at 0x0000018572246040, 16 bytes long.
 Data: <&#224; &#249; &#247;           > E0 02 F9 8F F7 7F 00 00 00 00 00 00 00 00 00 00 
{54} normal block at 0x0000018572245CD0, 16 bytes long.
 Data: <  &#249; &#247;           > 10 04 F9 8F F7 7F 00 00 00 00 00 00 00 00 00 00 
{53} normal block at 0x0000018572245640, 16 bytes long.
 Data: <p &#249; &#247;           > 70 04 F9 8F F7 7F 00 00 00 00 00 00 00 00 00 00 
{52} normal block at 0x0000018572245C80, 16 bytes long.
 Data: < &#192;&#247; &#247;           > 18 C0 F7 8F F7 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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