Task 38601582

Name MCL1_A26_A35_r0_1-QUICO_ATM_GAFF2_NAGL_MCL1-2-6-RND6600_0
Workunit 31556112
Created 9 Apr 2026, 15:11:50 UTC
Sent 9 Apr 2026, 15:12:05 UTC
Report deadline 14 Apr 2026, 15:12:05 UTC
Received 10 Apr 2026, 4:56:59 UTC
Server state Over
Outcome Computation error
Client state Compute error
Exit status 195 (0x000000C3) EXIT_CHILD_FAILED
Computer ID 609629
Run time 1 min 59 sec
CPU time 3 sec
Validate state Invalid
Credit 0.00
Device peak FLOPS 5,533.05 GFLOPS
Application version ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
Peak working set size 46.84 MB
Peak swap size 35.48 MB
Peak disk usage 1.54 GB

Stderr output

<core_client_version>7.20.2</core_client_version>
<![CDATA[
<message>
(unknown error) - exit code 195 (0xc3)</message>
<stderr_txt>
00:14:27 (17404): wrapper (7.9.26016): starting
00:14:27 (17404): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A26_A35_0.pdb
QB_A26_A35_0.xml
QB_A26_A35.inpcrd
QB_A26_A35_input.yaml
QB_A26_A35.pdb
QB_A26_A35.prmtop
QB_A26_A35_sys.xml
run.bat
run.sh
00:14:28 (17404): Library/usr/bin/tar.exe exited; CPU time 0.000000
00:14:28 (17404): 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 0x000001A29EACEC50>: 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 0x000001A29EADC8D0>: 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 0x000001A29EADD1D0>: 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 0x000001A29EADDA50>: 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 0x000001A29EADE390>: 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 0x0000012AB83496D0>: 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 0x0000012AB8349D10>: 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 0x0000012AB834AC10>: 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 0x0000012AB834B850>: 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 0x0000012AB8364410>: 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 'C:\\ProgramData\\BOINC\\slots\\7\\Scripts\\rbfe_production.exe': [Errno 2] No such file or directory
00:15:14 (17404): C:/Windows/system32/cmd.exe exited; CPU time 3.734375
00:15:14 (17404): app exit status: 0x16
00:15:14 (17404): called boinc_finish(195)
0 bytes in 0 Free Blocks.
616 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: 826409 bytes.
Dumping objects ->
{3835309} normal block at 0x0000023307A68520, 48 bytes long.
 Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835298} normal block at 0x0000023307A68830, 48 bytes long.
 Data: <HOME=C:\ProgramD> 48 4F 4D 45 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835287} normal block at 0x0000023307A67B10, 48 bytes long.
 Data: <TMP=C:\ProgramDa> 54 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 61 
{3835276} normal block at 0x0000023307A67FE0, 48 bytes long.
 Data: <TEMP=C:\ProgramD> 54 45 4D 50 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835265} normal block at 0x0000023307A67950, 48 bytes long.
 Data: <TMPDIR=C:\Progra> 54 4D 50 44 49 52 3D 43 3A 5C 50 72 6F 67 72 61 
{3835234} normal block at 0x00000233097F3DC0, 64 bytes long.
 Data: <PATH=C:\ProgramD> 50 41 54 48 3D 43 3A 5C 50 72 6F 67 72 61 6D 44 
{3835223} normal block at 0x0000023309853300, 180 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) : {3835220} normal block at 0x0000023307A3A130, 8 bytes long.
 Data: <    3   > 00 00 99 07 33 02 00 00 
{3834574} normal block at 0x0000023309852D60, 180 bytes long.
 Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65 
{3833947} normal block at 0x0000023307A39E10, 8 bytes long.
 Data: < : 	3   > 10 3A 88 09 33 02 00 00 
..\zip\boinc_zip.cpp(122) : {305} normal block at 0x0000023307A3F720, 260 bytes long.
 Data: <                > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 
{290} normal block at 0x0000023307A2A8B0, 80 bytes long.
 Data: </c call Scripts\> 2F 63 20 63 61 6C 6C 20 53 63 72 69 70 74 73 5C 
{289} normal block at 0x0000023307A45120, 16 bytes long.
 Data: < W&#164; 3           > 88 57 A4 07 33 02 00 00 00 00 00 00 00 00 00 00 
{288} normal block at 0x0000023307A45300, 16 bytes long.
 Data: <`W&#164; 3           > 60 57 A4 07 33 02 00 00 00 00 00 00 00 00 00 00 
{287} normal block at 0x0000023307A40120, 32 bytes long.
 Data: <r0/checkpoint.xm> 72 30 2F 63 68 65 63 6B 70 6F 69 6E 74 2E 78 6D 
{286} normal block at 0x0000023307A450D0, 16 bytes long.
 Data: <8W&#164; 3           > 38 57 A4 07 33 02 00 00 00 00 00 00 00 00 00 00 
{285} normal block at 0x0000023307A44A90, 16 bytes long.
 Data: < W&#164; 3           > 10 57 A4 07 33 02 00 00 00 00 00 00 00 00 00 00 
{284} normal block at 0x0000023307A44D10, 16 bytes long.
 Data: <&#232;V&#164; 3           > E8 56 A4 07 33 02 00 00 00 00 00 00 00 00 00 00 
{283} normal block at 0x0000023307A44630, 16 bytes long.
 Data: <&#192;V&#164; 3           > C0 56 A4 07 33 02 00 00 00 00 00 00 00 00 00 00 
{282} normal block at 0x0000023307A3E690, 48 bytes long.
 Data: <ComSpec=C:\Windo> 43 6F 6D 53 70 65 63 3D 43 3A 5C 57 69 6E 64 6F 
{281} normal block at 0x0000023307A44BD0, 16 bytes long.
 Data: <x&#216;&#162; 3           > 78 D8 A2 07 33 02 00 00 00 00 00 00 00 00 00 00 
{280} normal block at 0x0000023307A40000, 32 bytes long.
 Data: <SystemRoot=C:\Wi> 53 79 73 74 65 6D 52 6F 6F 74 3D 43 3A 5C 57 69 
{279} normal block at 0x0000023307A453A0, 16 bytes long.
 Data: <P&#216;&#162; 3           > 50 D8 A2 07 33 02 00 00 00 00 00 00 00 00 00 00 
{277} normal block at 0x0000023307A45030, 16 bytes long.
 Data: <(&#216;&#162; 3           > 28 D8 A2 07 33 02 00 00 00 00 00 00 00 00 00 00 
{276} normal block at 0x0000023307A452B0, 16 bytes long.
 Data: < &#216;&#162; 3           > 00 D8 A2 07 33 02 00 00 00 00 00 00 00 00 00 00 
{275} normal block at 0x0000023307A44540, 16 bytes long.
 Data: <&#216;&#215;&#162; 3           > D8 D7 A2 07 33 02 00 00 00 00 00 00 00 00 00 00 
{274} normal block at 0x0000023307A44EF0, 16 bytes long.
 Data: <&#176;&#215;&#162; 3           > B0 D7 A2 07 33 02 00 00 00 00 00 00 00 00 00 00 
{273} normal block at 0x0000023307A44E00, 16 bytes long.
 Data: < &#215;&#162; 3           > 88 D7 A2 07 33 02 00 00 00 00 00 00 00 00 00 00 
{272} normal block at 0x0000023307A400C0, 32 bytes long.
 Data: <CUDA_DEVICE=0 PU> 43 55 44 41 5F 44 45 56 49 43 45 3D 30 00 50 55 
{271} normal block at 0x0000023307A447C0, 16 bytes long.
 Data: <`&#215;&#162; 3           > 60 D7 A2 07 33 02 00 00 00 00 00 00 00 00 00 00 
{270} normal block at 0x0000023307A2D760, 320 bytes long.
 Data: <&#192;G&#164; 3   &#192; &#164; 3   > C0 47 A4 07 33 02 00 00 C0 00 A4 07 33 02 00 00 
{269} normal block at 0x0000023307A45260, 16 bytes long.
 Data: <&#160;V&#164; 3           > A0 56 A4 07 33 02 00 00 00 00 00 00 00 00 00 00 
{268} normal block at 0x0000023307A44CC0, 16 bytes long.
 Data: <xV&#164; 3           > 78 56 A4 07 33 02 00 00 00 00 00 00 00 00 00 00 
{267} normal block at 0x0000023307A3FEE0, 32 bytes long.
 Data: <C:/Windows/syste> 43 3A 2F 57 69 6E 64 6F 77 73 2F 73 79 73 74 65 
{266} normal block at 0x0000023307A44B30, 16 bytes long.
 Data: <PV&#164; 3           > 50 56 A4 07 33 02 00 00 00 00 00 00 00 00 00 00 
{265} normal block at 0x0000023307A40240, 32 bytes long.
 Data: <xjvf input.tar.b> 78 6A 76 66 20 69 6E 70 75 74 2E 74 61 72 2E 62 
{264} normal block at 0x0000023307A44DB0, 16 bytes long.
 Data: < U&#164; 3           > 98 55 A4 07 33 02 00 00 00 00 00 00 00 00 00 00 
{263} normal block at 0x0000023307A45210, 16 bytes long.
 Data: <pU&#164; 3           > 70 55 A4 07 33 02 00 00 00 00 00 00 00 00 00 00 
{262} normal block at 0x0000023307A44720, 16 bytes long.
 Data: <HU&#164; 3           > 48 55 A4 07 33 02 00 00 00 00 00 00 00 00 00 00 
{261} normal block at 0x0000023307A44FE0, 16 bytes long.
 Data: < U&#164; 3           > 20 55 A4 07 33 02 00 00 00 00 00 00 00 00 00 00 
{260} normal block at 0x0000023307A44B80, 16 bytes long.
 Data: <&#248;T&#164; 3           > F8 54 A4 07 33 02 00 00 00 00 00 00 00 00 00 00 
{259} normal block at 0x0000023307A44860, 16 bytes long.
 Data: <&#208;T&#164; 3           > D0 54 A4 07 33 02 00 00 00 00 00 00 00 00 00 00 
{257} normal block at 0x0000023307A44F90, 16 bytes long.
 Data: < &#230;&#163; 3           > 20 E6 A3 07 33 02 00 00 00 00 00 00 00 00 00 00 
{256} normal block at 0x0000023307A3E620, 40 bytes long.
 Data: <&#144;O&#164; 3   &#192;= 	3   > 90 4F A4 07 33 02 00 00 C0 3D 7F 09 33 02 00 00 
{255} normal block at 0x0000023307A44F40, 16 bytes long.
 Data: <&#176;T&#164; 3           > B0 54 A4 07 33 02 00 00 00 00 00 00 00 00 00 00 
{254} normal block at 0x0000023307A449A0, 16 bytes long.
 Data: < T&#164; 3           > 88 54 A4 07 33 02 00 00 00 00 00 00 00 00 00 00 
{253} normal block at 0x0000023307A3F940, 32 bytes long.
 Data: <Library/usr/bin/> 4C 69 62 72 61 72 79 2F 75 73 72 2F 62 69 6E 2F 
{252} normal block at 0x0000023307A45350, 16 bytes long.
 Data: <`T&#164; 3           > 60 54 A4 07 33 02 00 00 00 00 00 00 00 00 00 00 
{251} normal block at 0x0000023307A45460, 992 bytes long.
 Data: <PS&#164; 3   @&#249;&#163; 3   > 50 53 A4 07 33 02 00 00 40 F9 A3 07 33 02 00 00 
{87} normal block at 0x0000023307A40420, 32 bytes long.
 Data: <windows_x86_64__> 77 69 6E 64 6F 77 73 5F 78 38 36 5F 36 34 5F 5F 
{86} normal block at 0x0000023307A3A0E0, 16 bytes long.
 Data: <@&#229;&#163; 3           > 40 E5 A3 07 33 02 00 00 00 00 00 00 00 00 00 00 
{85} normal block at 0x0000023307A3E540, 40 bytes long.
 Data: <&#224;&#160;&#163; 3     &#164; 3   > E0 A0 A3 07 33 02 00 00 20 04 A4 07 33 02 00 00 
{64} normal block at 0x0000023307A3A040, 16 bytes long.
 Data: <&#128;&#234;|W&#247;           > 80 EA 7C 57 F7 7F 00 00 00 00 00 00 00 00 00 00 
{63} normal block at 0x0000023307A3A4F0, 16 bytes long.
 Data: <@&#233;|W&#247;           > 40 E9 7C 57 F7 7F 00 00 00 00 00 00 00 00 00 00 
{62} normal block at 0x0000023307A39AF0, 16 bytes long.
 Data: <&#248;WyW&#247;           > F8 57 79 57 F7 7F 00 00 00 00 00 00 00 00 00 00 
{61} normal block at 0x0000023307A3A2C0, 16 bytes long.
 Data: <&#216;WyW&#247;           > D8 57 79 57 F7 7F 00 00 00 00 00 00 00 00 00 00 
{60} normal block at 0x0000023307A39E60, 16 bytes long.
 Data: <P yW&#247;           > 50 04 79 57 F7 7F 00 00 00 00 00 00 00 00 00 00 
{59} normal block at 0x0000023307A39B40, 16 bytes long.
 Data: <0 yW&#247;           > 30 04 79 57 F7 7F 00 00 00 00 00 00 00 00 00 00 
{58} normal block at 0x0000023307A39C30, 16 bytes long.
 Data: <&#224; yW&#247;           > E0 02 79 57 F7 7F 00 00 00 00 00 00 00 00 00 00 
{57} normal block at 0x0000023307A3A270, 16 bytes long.
 Data: <  yW&#247;           > 10 04 79 57 F7 7F 00 00 00 00 00 00 00 00 00 00 
{56} normal block at 0x0000023307A39820, 16 bytes long.
 Data: <p yW&#247;           > 70 04 79 57 F7 7F 00 00 00 00 00 00 00 00 00 00 
{55} normal block at 0x0000023307A3A220, 16 bytes long.
 Data: < &#192;wW&#247;           > 18 C0 77 57 F7 7F 00 00 00 00 00 00 00 00 00 00 
Object dump complete.

</stderr_txt>
]]>


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