| Name | MCL1_RE_A14_A05_r0_3-QUICO_ATM_GAFF2_NAGL_MCL1_RE-5-6-RND7997_0 |
| Workunit | 31585841 |
| Created | 29 Apr 2026, 22:43:34 UTC |
| Sent | 29 Apr 2026, 22:43:43 UTC |
| Report deadline | 4 May 2026, 22:43:43 UTC |
| Received | 11 May 2026, 0:18:22 UTC |
| Server state | Over |
| Outcome | Success |
| Client state | Done |
| Exit status | 0 (0x00000000) |
| Computer ID | 479807 |
| Run time | 4 hours 51 min 17 sec |
| CPU time | 3 hours 46 min 52 sec |
| Validate state | Task was reported too late to validate |
| Credit | 0.00 |
| Device peak FLOPS | 31,863.18 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 441.77 MB |
| Peak swap size | 6.62 GB |
| Peak disk usage | 2.95 GB |
<core_client_version>8.2.8</core_client_version>
<![CDATA[
<stderr_txt>
00:33:14 (18352): wrapper (7.9.26016): starting
00:33:14 (18352): wrapper: running Library/usr/bin/tar.exe (xjvf input.tar.bz2)
QB_A14_A05_0.pdb
QB_A14_A05_0.xml
QB_A14_A05.inpcrd
QB_A14_A05_input.yaml
QB_A14_A05.pdb
QB_A14_A05.prmtop
QB_A14_A05_sys.xml
run.bat
run.sh
00:33:17 (18352): Library/usr/bin/tar.exe exited; CPU time 0.000000
00:33:17 (18352): 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 'D:\BOINC\BoincData\slots\0\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 'D:\BOINC\BoincData\slots\0\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.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {3835275} normal block at 0x0000026EBB40BDB0, 8 bytes long.
Data: < n > 00 00 8E BB 6E 02 00 00
..\lib\diagnostics_win.cpp(417) : {3833956} normal block at 0x0000026EBDAE0D20, 1080 bytes long.
Data: <p? > 70 3F 00 00 CD CD CD CD E8 02 00 00 00 00 00 00
..\zip\boinc_zip.cpp(122) : {310} normal block at 0x0000026EBB400DD0, 260 bytes long.
Data: < > 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00 00
Object dump complete.
07:29:24 (7940): wrapper (7.9.26016): starting
07:29:24 (7940): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x0000016EC1B04330, 8 bytes long.
Data: < n > 00 00 CC C1 6E 01 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x0000016EC1B04900, 1080 bytes long.
Data: < X > 00 1A 00 00 CD CD CD CD 58 01 00 00 00 00 00 00
Object dump complete.
07:30:05 (13100): wrapper (7.9.26016): starting
07:30:05 (13100): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x00000185FC623D40, 8 bytes long.
Data: < > 00 00 91 FC 85 01 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x00000185FC624900, 1080 bytes long.
Data: < 7 > 98 37 00 00 CD CD CD CD 84 01 00 00 00 00 00 00
Object dump complete.
08:00:03 (6884): wrapper (7.9.26016): starting
08:00:03 (6884): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x000001F2B44E3CF0, 8 bytes long.
Data: < > 00 00 94 B4 F2 01 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x000001F2B44E4900, 1080 bytes long.
Data: < Z x > D0 5A 00 00 CD CD CD CD 78 01 00 00 00 00 00 00
Object dump complete.
08:30:03 (2592): wrapper (7.9.26016): starting
08:30:03 (2592): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x0000023C17293CA0, 8 bytes long.
Data: < m < > 00 00 6D 17 3C 02 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x0000023C17294900, 1080 bytes long.
Data: < S t > BC 53 00 00 CD CD CD CD 74 01 00 00 00 00 00 00
Object dump complete.
09:00:02 (1424): wrapper (7.9.26016): starting
09:00:02 (1424): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x00000203F7F74100, 8 bytes long.
Data: < ) > 00 00 29 F8 03 02 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x00000203F7F74900, 1080 bytes long.
Data: < | > B8 0B 00 00 CD CD CD CD 7C 01 00 00 00 00 00 00
Object dump complete.
09:30:03 (17348): wrapper (7.9.26016): starting
09:30:03 (17348): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x000002660C8D41A0, 8 bytes long.
Data: < f > 00 00 B5 0C 66 02 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x000002660C8D4900, 1080 bytes long.
Data: < | > 00 1F 00 00 CD CD CD CD 7C 01 00 00 00 00 00 00
Object dump complete.
10:00:02 (4028): wrapper (7.9.26016): starting
10:00:02 (4028): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x000001AD283A4100, 8 bytes long.
Data: < T( > 00 00 54 28 AD 01 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x000001AD283A4900, 1080 bytes long.
Data: < P x > A4 50 00 00 CD CD CD CD 78 01 00 00 00 00 00 00
Object dump complete.
10:30:03 (13304): wrapper (7.9.26016): starting
10:30:03 (13304): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x000001B560674330, 8 bytes long.
Data: < ` > 00 00 A8 60 B5 01 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x000001B560674900, 1080 bytes long.
Data: <4S | > 34 53 00 00 CD CD CD CD 7C 01 00 00 00 00 00 00
Object dump complete.
11:00:02 (13828): wrapper (7.9.26016): starting
11:00:02 (13828): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x0000023E9DDE41A0, 8 bytes long.
Data: < > > 00 00 17 9E 3E 02 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x0000023E9DDE4900, 1080 bytes long.
Data: <8 t > 38 1E 00 00 CD CD CD CD 74 01 00 00 00 00 00 00
Object dump complete.
11:30:03 (19612): wrapper (7.9.26016): starting
11:30:03 (19612): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x000001EA2EA43570, 8 bytes long.
Data: < . > 00 00 C8 2E EA 01 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x000001EA2EA44900, 1080 bytes long.
Data: < 5 l > A0 35 00 00 CD CD CD CD 6C 01 00 00 00 00 00 00
Object dump complete.
12:00:03 (22556): wrapper (7.9.26016): starting
12:00:03 (22556): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x00000190E98936B0, 8 bytes long.
Data: < > 00 00 C6 E9 90 01 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x00000190E9894900, 1080 bytes long.
Data: <,O | > 2C 4F 00 00 CD CD CD CD 7C 01 00 00 00 00 00 00
Object dump complete.
12:30:04 (17304): wrapper (7.9.26016): starting
12:30:04 (17304): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x00000165160A3ED0, 8 bytes long.
Data: < : e > 00 00 3A 16 65 01 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x00000165160A4900, 1080 bytes long.
Data: <L5 x > 4C 35 00 00 CD CD CD CD 78 01 00 00 00 00 00 00
Object dump complete.
13:00:05 (18892): wrapper (7.9.26016): starting
13:00:05 (18892): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x00000195DEB54010, 8 bytes long.
Data: < > 00 00 E0 DE 95 01 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x00000195DEB54900, 1080 bytes long.
Data: < P t > B0 50 00 00 CD CD CD CD 74 01 00 00 00 00 00 00
Object dump complete.
13:15:51 (19608): wrapper (7.9.26016): starting
13:15:51 (19608): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x00000182D34239D0, 8 bytes long.
Data: < > 00 00 A6 D5 82 01 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x00000182D3424900, 1080 bytes long.
Data: < x > 94 1E 00 00 CD CD CD CD 78 01 00 00 00 00 00 00
Object dump complete.
13:16:45 (18076): wrapper (7.9.26016): starting
13:16:45 (18076): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x000002B24DD03F70, 8 bytes long.
Data: < N > 00 00 02 4E B2 02 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x000002B24DD04900, 1080 bytes long.
Data: < 2 | > 1C 32 00 00 CD CD CD CD 7C 01 00 00 00 00 00 00
Object dump complete.
13:30:04 (3428): wrapper (7.9.26016): starting
13:30:04 (3428): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x000002BCD55E3E30, 8 bytes long.
Data: < > 00 00 91 D5 BC 02 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x000002BCD55E4900, 1080 bytes long.
Data: <X | > 58 10 00 00 CD CD CD CD 7C 01 00 00 00 00 00 00
Object dump complete.
13:37:02 (22840): wrapper (7.9.26016): starting
13:37:02 (22840): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x0000017B01713570, 8 bytes long.
Data: < { > 00 00 BE 01 7B 01 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x0000017B01714900, 1080 bytes long.
Data: < Q t > 84 51 00 00 CD CD CD CD 74 01 00 00 00 00 00 00
Object dump complete.
13:59:22 (19332): wrapper (7.9.26016): starting
13:59:22 (19332): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x000002115AB73B10, 8 bytes long.
Data: < [ > 00 00 13 5B 11 02 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x000002115AB74900, 1080 bytes long.
Data: < / > 88 2F 00 00 CD CD CD CD B4 00 00 00 00 00 00 00
Object dump complete.
14:00:05 (2384): wrapper (7.9.26016): starting
14:00:05 (2384): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x0000024238453BB0, 8 bytes long.
Data: < 8B > 00 00 A4 38 42 02 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x0000024238454900, 1080 bytes long.
Data: < X > E4 17 00 00 CD CD CD CD 58 01 00 00 00 00 00 00
Object dump complete.
14:01:05 (19600): wrapper (7.9.26016): starting
14:01:05 (19600): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x00000292E7754060, 8 bytes long.
Data: < > 00 00 D4 E7 92 02 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x00000292E7754900, 1080 bytes long.
Data: < 8 | > F4 38 00 00 CD CD CD CD 7C 01 00 00 00 00 00 00
Object dump complete.
14:04:26 (6152): wrapper (7.9.26016): starting
14:04:26 (6152): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x0000025788E64150, 8 bytes long.
Data: < W > 00 00 11 89 57 02 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x0000025788E64900, 1080 bytes long.
Data: < > FC 0C 00 00 CD CD CD CD 84 01 00 00 00 00 00 00
Object dump complete.
14:30:04 (8204): wrapper (7.9.26016): starting
14:30:04 (8204): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x000001DB41A63CA0, 8 bytes long.
Data: < A > 00 00 F2 41 DB 01 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x000001DB41A64900, 1080 bytes long.
Data: < > B8 17 00 00 CD CD CD CD 80 01 00 00 00 00 00 00
Object dump complete.
14:41:27 (12944): wrapper (7.9.26016): starting
14:41:27 (12944): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x0000017C391D3FC0, 8 bytes long.
Data: < a9| > 00 00 61 39 7C 01 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x0000017C391D4900, 1080 bytes long.
Data: <(R t > 28 52 00 00 CD CD CD CD 74 01 00 00 00 00 00 00
Object dump complete.
14:42:30 (24512): wrapper (7.9.26016): starting
14:42:30 (24512): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x000001FFFE584060, 8 bytes long.
Data: < > 00 00 8F FE FF 01 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x000001FFFE584900, 1080 bytes long.
Data: < ! t > BC 21 00 00 CD CD CD CD 74 01 00 00 00 00 00 00
Object dump complete.
14:45:42 (5860): wrapper (7.9.26016): starting
14:45:42 (5860): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x0000018C431C3610, 8 bytes long.
Data: < C > 00 00 7F 43 8C 01 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x0000018C431C4900, 1080 bytes long.
Data: < [ > 0C 5B 00 00 CD CD CD CD B8 00 00 00 00 00 00 00
Object dump complete.
15:00:03 (8272): wrapper (7.9.26016): starting
15:00:03 (8272): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x0000022E6D823E80, 8 bytes long.
Data: < m. > 00 00 D6 6D 2E 02 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x0000022E6D824900, 1080 bytes long.
Data: < @ t > E4 40 00 00 CD CD CD CD 74 01 00 00 00 00 00 00
Object dump complete.
15:30:06 (24384): wrapper (7.9.26016): starting
15:30:06 (24384): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
21:53:57 (13700): wrapper (7.9.26016): starting
21:53:57 (13700): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x000001E86F6A3980, 8 bytes long.
Data: < o > 00 00 AA 6F E8 01 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x000001E86F6A4900, 1080 bytes long.
Data: < l > CC 09 00 00 CD CD CD CD 6C 01 00 00 00 00 00 00
Object dump complete.
00:13:02 (6404): wrapper (7.9.26016): starting
00:13:02 (6404): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
14:00:08 (22212): wrapper (7.9.26016): starting
14:00:08 (22212): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x000001D435A84150, 8 bytes long.
Data: < 6 > 00 00 0B 36 D4 01 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x000001D435A84900, 1080 bytes long.
Data: < t > D4 1C 00 00 CD CD CD CD 74 01 00 00 00 00 00 00
Object dump complete.
15:00:04 (12988): wrapper (7.9.26016): starting
15:00:04 (12988): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x000001DEB95C39D0, 8 bytes long.
Data: < > 00 00 9B B9 DE 01 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x000001DEB95C4900, 1080 bytes long.
Data: <(e | > 28 65 00 00 CD CD CD CD 7C 01 00 00 00 00 00 00
Object dump complete.
20:40:28 (20456): wrapper (7.9.26016): starting
20:40:28 (20456): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
Detected memory leaks!
Dumping objects ->
..\api\boinc_api.cpp(309) : {1622} normal block at 0x0000024FA5DE3ED0, 8 bytes long.
Data: < , O > 00 00 2C A6 4F 02 00 00
..\lib\diagnostics_win.cpp(417) : {303} normal block at 0x0000024FA5DE4900, 1080 bytes long.
Data: <LZ t > 4C 5A 00 00 CD CD CD CD 74 01 00 00 00 00 00 00
Object dump complete.
00:28:33 (6480): wrapper (7.9.26016): starting
00:28:33 (6480): wrapper: running C:/Windows/system32/cmd.exe (/c call Scripts\activate.bat && Scripts\conda-unpack.exe && run.bat)
A subdirectory or file D:\BOINC\BoincData\slots\0\tmp already exists.
Warning: importing 'simtk.openmm' is deprecated. Import 'openmm' instead.
tar: run.log: file changed as we read it
01:17:51 (6480): C:/Windows/system32/cmd.exe exited; CPU time 2266.437500
01:17:51 (6480): called boinc_finish(0)
0 bytes in 0 Free Blocks.
472 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: 47191090 bytes.
Dumping objects ->
{1705} normal block at 0x0000025209F8F9C0, 48 bytes long.
Data: <PATH=D:\BOINC\Bo> 50 41 54 48 3D 44 3A 5C 42 4F 49 4E 43 5C 42 6F
{1694} normal block at 0x0000025209F8E110, 32 bytes long.
Data: <HOME=D:\BOINC\Bo> 48 4F 4D 45 3D 44 3A 5C 42 4F 49 4E 43 5C 42 6F
{1683} normal block at 0x0000025209F8D510, 32 bytes long.
Data: <TMP=D:\BOINC\Boi> 54 4D 50 3D 44 3A 5C 42 4F 49 4E 43 5C 42 6F 69
{1672} normal block at 0x0000025209F8D7B0, 32 bytes long.
Data: <TEMP=D:\BOINC\Bo> 54 45 4D 50 3D 44 3A 5C 42 4F 49 4E 43 5C 42 6F
{1661} normal block at 0x0000025209F8F870, 48 bytes long.
Data: <TMPDIR=D:\BOINC\> 54 4D 50 44 49 52 3D 44 3A 5C 42 4F 49 4E 43 5C
{1630} normal block at 0x0000025209F8F800, 48 bytes long.
Data: <PATH=D:\BOINC\Bo> 50 41 54 48 3D 44 3A 5C 42 4F 49 4E 43 5C 42 6F
{1619} normal block at 0x0000025209F7BF70, 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) : {1616} normal block at 0x0000025209F93980, 8 bytes long.
Data: < J R > 00 00 4A 0A 52 02 00 00
{962} normal block at 0x0000025209F7C2B0, 140 bytes long.
Data: <<project_prefere> 3C 70 72 6F 6A 65 63 74 5F 70 72 65 66 65 72 65
{304} normal block at 0x0000025209F940B0, 8 bytes long.
Data: < I R > 00 49 F9 09 52 02 00 00
{295} normal block at 0x0000025209F7E730, 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 0x0000025209F93F70, 16 bytes long.
Data: < H R > 08 48 F9 09 52 02 00 00 00 00 00 00 00 00 00 00
{293} normal block at 0x0000025209F935C0, 16 bytes long.
Data: < G R > E0 47 F9 09 52 02 00 00 00 00 00 00 00 00 00 00
{292} normal block at 0x0000025209F8DCF0, 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 0x0000025209F93CA0, 16 bytes long.
Data: < G R > B8 47 F9 09 52 02 00 00 00 00 00 00 00 00 00 00
{290} normal block at 0x0000025209F93BB0, 16 bytes long.
Data: < G R > 90 47 F9 09 52 02 00 00 00 00 00 00 00 00 00 00
{289} normal block at 0x0000025209F943D0, 16 bytes long.
Data: <hG R > 68 47 F9 09 52 02 00 00 00 00 00 00 00 00 00 00
{288} normal block at 0x0000025209F93A70, 16 bytes long.
Data: <@G R > 40 47 F9 09 52 02 00 00 00 00 00 00 00 00 00 00
{287} normal block at 0x0000025209F8FAA0, 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 0x0000025209F93ED0, 16 bytes long.
Data: <X R > 58 18 F8 09 52 02 00 00 00 00 00 00 00 00 00 00
{285} normal block at 0x0000025209F8DF90, 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 0x0000025209F93D90, 16 bytes long.
Data: <0 R > 30 18 F8 09 52 02 00 00 00 00 00 00 00 00 00 00
{282} normal block at 0x0000025209F93570, 16 bytes long.
Data: < R > 08 18 F8 09 52 02 00 00 00 00 00 00 00 00 00 00
{281} normal block at 0x0000025209F93840, 16 bytes long.
Data: < R > E0 17 F8 09 52 02 00 00 00 00 00 00 00 00 00 00
{280} normal block at 0x0000025209F93FC0, 16 bytes long.
Data: < R > B8 17 F8 09 52 02 00 00 00 00 00 00 00 00 00 00
{279} normal block at 0x0000025209F93520, 16 bytes long.
Data: < R > 90 17 F8 09 52 02 00 00 00 00 00 00 00 00 00 00
{278} normal block at 0x0000025209F93B60, 16 bytes long.
Data: <h R > 68 17 F8 09 52 02 00 00 00 00 00 00 00 00 00 00
{277} normal block at 0x0000025209F8DB70, 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 0x0000025209F941F0, 16 bytes long.
Data: <@ R > 40 17 F8 09 52 02 00 00 00 00 00 00 00 00 00 00
{275} normal block at 0x0000025209F81740, 320 bytes long.
Data: < A R p R > F0 41 F9 09 52 02 00 00 70 DB F8 09 52 02 00 00
{274} normal block at 0x0000025209F939D0, 16 bytes long.
Data: < G R > 20 47 F9 09 52 02 00 00 00 00 00 00 00 00 00 00
{273} normal block at 0x0000025209F94330, 16 bytes long.
Data: < F R > F8 46 F9 09 52 02 00 00 00 00 00 00 00 00 00 00
{272} normal block at 0x0000025209F8DE70, 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 0x0000025209F942E0, 16 bytes long.
Data: < F R > D0 46 F9 09 52 02 00 00 00 00 00 00 00 00 00 00
{270} normal block at 0x0000025209F8D4B0, 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 0x0000025209F94290, 16 bytes long.
Data: < F R > 18 46 F9 09 52 02 00 00 00 00 00 00 00 00 00 00
{268} normal block at 0x0000025209F94380, 16 bytes long.
Data: < E R > F0 45 F9 09 52 02 00 00 00 00 00 00 00 00 00 00
{267} normal block at 0x0000025209F93E80, 16 bytes long.
Data: < E R > C8 45 F9 09 52 02 00 00 00 00 00 00 00 00 00 00
{266} normal block at 0x0000025209F93610, 16 bytes long.
Data: < E R > A0 45 F9 09 52 02 00 00 00 00 00 00 00 00 00 00
{265} normal block at 0x0000025209F93700, 16 bytes long.
Data: <xE R > 78 45 F9 09 52 02 00 00 00 00 00 00 00 00 00 00
{264} normal block at 0x0000025209F93B10, 16 bytes long.
Data: <PE R > 50 45 F9 09 52 02 00 00 00 00 00 00 00 00 00 00
{262} normal block at 0x0000025209F93CF0, 16 bytes long.
Data: < R > 10 FB F8 09 52 02 00 00 00 00 00 00 00 00 00 00
{261} normal block at 0x0000025209F8FB10, 40 bytes long.
Data: < < R R > F0 3C F9 09 52 02 00 00 00 F8 F8 09 52 02 00 00
{260} normal block at 0x0000025209F94100, 16 bytes long.
Data: <0E R > 30 45 F9 09 52 02 00 00 00 00 00 00 00 00 00 00
{259} normal block at 0x0000025209F941A0, 16 bytes long.
Data: < E R > 08 45 F9 09 52 02 00 00 00 00 00 00 00 00 00 00
{258} normal block at 0x0000025209F8DAB0, 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 0x0000025209F93E30, 16 bytes long.
Data: < D R > E0 44 F9 09 52 02 00 00 00 00 00 00 00 00 00 00
{256} normal block at 0x0000025209F944E0, 992 bytes long.
Data: <0> R R > 30 3E F9 09 52 02 00 00 B0 DA F8 09 52 02 00 00
{92} normal block at 0x0000025209F8DE10, 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 0x0000025209F8BE50, 16 bytes long.
Data: <@ R > 40 F6 F8 09 52 02 00 00 00 00 00 00 00 00 00 00
{90} normal block at 0x0000025209F8F640, 40 bytes long.
Data: <P R R > 50 BE F8 09 52 02 00 00 10 DE F8 09 52 02 00 00
{69} normal block at 0x0000025209F8B680, 16 bytes long.
Data: < > 80 EA AD C1 F7 7F 00 00 00 00 00 00 00 00 00 00
{68} normal block at 0x0000025209F8B630, 16 bytes long.
Data: <@ > 40 E9 AD C1 F7 7F 00 00 00 00 00 00 00 00 00 00
{67} normal block at 0x0000025209F8B220, 16 bytes long.
Data: < W > F8 57 AA C1 F7 7F 00 00 00 00 00 00 00 00 00 00
{66} normal block at 0x0000025209F8B950, 16 bytes long.
Data: < W > D8 57 AA C1 F7 7F 00 00 00 00 00 00 00 00 00 00
{65} normal block at 0x0000025209F8AFF0, 16 bytes long.
Data: <P > 50 04 AA C1 F7 7F 00 00 00 00 00 00 00 00 00 00
{64} normal block at 0x0000025209F8B400, 16 bytes long.
Data: <0 > 30 04 AA C1 F7 7F 00 00 00 00 00 00 00 00 00 00
{63} normal block at 0x0000025209F8B040, 16 bytes long.
Data: < > E0 02 AA C1 F7 7F 00 00 00 00 00 00 00 00 00 00
{62} normal block at 0x0000025209F8B4F0, 16 bytes long.
Data: < > 10 04 AA C1 F7 7F 00 00 00 00 00 00 00 00 00 00
{61} normal block at 0x0000025209F8B720, 16 bytes long.
Data: <p > 70 04 AA C1 F7 7F 00 00 00 00 00 00 00 00 00 00
{60} normal block at 0x0000025209F8B900, 16 bytes long.
Data: < > 18 C0 A8 C1 F7 7F 00 00 00 00 00 00 00 00 00 00
Object dump complete.
</stderr_txt>
]]>
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