Task 1626176577

Name RosettaVS_SAVE_ALL_OUT_NOJRAN_betaTrCP_frame_1772_fulldb_IGNORE_THE_REST_ztj9FL_10_5400_3022877_3_0
Workunit 1446674343
Created 27 Dec 2025, 14:19:12 UTC
Sent 27 Dec 2025, 14:58:00 UTC
Report deadline 30 Dec 2025, 14:58:00 UTC
Received 28 Dec 2025, 12:30:00 UTC
Server state Over
Outcome Success
Client state Done
Exit status 0 (0x00000000)
Computer ID 4163485
Run time 9 hours 36 min 2 sec
CPU time 7 hours 57 min 51 sec
Validate state Valid
Credit 614.02
Device peak FLOPS 5.54 GFLOPS
Application version Rosetta Beta v6.06
x86_64-apple-darwin
Peak working set size 933.83 MB
Peak swap size 35,566.07 MB
Peak disk usage 25.37 MB

Stderr output

<core_client_version>8.0.2</core_client_version>
<![CDATA[
<stderr_txt>
command: rosetta_beta_6.06_x86_64-apple-darwin @betaTrCP_frame_1772_fulldb_ztj9FL_10_5400.flags -nstruct 10000 -cpu_run_time 28800 -boinc:max_nstruct 20000 -checkpoint_interval 120 -mute all -database minirosetta_database -in::file::zip minirosetta_database.zip -boinc::watchdog -boinc::cpu_run_timeout 36000 -run::rng mt19937
Using database: database_f5ae1de8e1/database
Starting watchdog...
Watchdog active.

[ ERROR ]: Caught exception:


File: src/core/kinematics/Stub.cc:106
Error in Stub::from_four_points(): 

File: src/numeric/xyzVector.hh:654
Cannot create normalized xyzVector from vector of length() zero.  Error occurred when trying to normalize the vector between points A and B.  A=[-3265023250781391360.000000,-18406341952063391744.000000,674036842228219392.000000], B=[-3265023250781391360.000000,-18406341952063391744.000000,674036842228219392.000000].
 ------------------------ Begin developer's backtrace ------------------------- 
BACKTRACE:
0   rosetta_beta_6.06_x86_64-apple-darw 0x0000000108b60ec7 backtrace_string(int) + 87
1   rosetta_beta_6.06_x86_64-apple-darw 0x0000000108b74a1d utility::excn::Exception::Exception(char const*, int, std::__1::basic_string<char, std::__1::char_traits<char>, std::__1::allocator<char>> const&) + 205
2   rosetta_beta_6.06_x86_64-apple-darw 0x0000000108751037 core::kinematics::Stub::from_four_points(numeric::xyzVector<double> const&, numeric::xyzVector<double> const&, numeric::xyzVector<double> const&, numeric::xyzVector<double> const&) + 2071
3   rosetta_beta_6.06_x86_64-apple-darw 0x00000001080a08cf core::scoring::lkball::LKB_ResidueInfo::build_waters(core::conformation::Residue const&, bool) + 895
4   rosetta_beta_6.06_x86_64-apple-darw 0x00000001080a01ae core::scoring::lkball::LKB_ResidueInfo::LKB_ResidueInfo(core::conformation::Residue const&, bool) + 270
5   rosetta_beta_6.06_x86_64-apple-darw 0x0000000105752b53 std::__1::shared_ptr<core::scoring::lkball::LKB_ResidueInfo> std::__1::shared_ptr<core::scoring::lkball::LKB_ResidueInfo>::make_shared<core::conformation::Residue const&>(core::conformation::Residue const&) + 83
6   rosetta_beta_6.06_x86_64-apple-darw 0x00000001057417c9 protocols::ligand_docking::ga_ligand_dock::GridScorer::score(core::pose::Pose&, protocols::ligand_docking::ga_ligand_dock::LigandConformer const&, bool) + 777
7   rosetta_beta_6.06_x86_64-apple-darw 0x0000000106f55642 core::optimization::ArmijoLineMinimization::Armijo(double, core::optimization::func_1d&) + 130
8   rosetta_beta_6.06_x86_64-apple-darw 0x0000000106f5535e core::optimization::ArmijoLineMinimization::operator()(utility::vector1<double, std::__1::allocator<double>>&, utility::vector1<double, std::__1::allocator<double>>&) + 494
9   rosetta_beta_6.06_x86_64-apple-darw 0x0000000106f5e0b9 core::optimization::Minimizer::lbfgs(utility::vector1<double, std::__1::allocator<double>>&, double&, core::optimization::ConvergenceTest&, std::__1::shared_ptr<core::optimization::LineMinimizationAlgorithm>, int, bool) const + 3177
10  rosetta_beta_6.06_x86_64-apple-darw 0x0000000106f5902f core::optimization::Minimizer::run(utility::vector1<double, std::__1::allocator<double>>&) + 6975
11  rosetta_beta_6.06_x86_64-apple-darw 0x000000010575052c protocols::ligand_docking::ga_ligand_dock::GridScorer::minimizer_loop(protocols::ligand_docking::ga_ligand_dock::LigandConformer&, core::optimization::MinimizerOptions const&) + 1884
12  rosetta_beta_6.06_x86_64-apple-darw 0x000000010574d770 protocols::ligand_docking::ga_ligand_dock::GridScorer::optimize(protocols::ligand_docking::ga_ligand_dock::LigandConformer&, utility::vector1<double, std::__1::allocator<double>>, utility::vector1<utility::vector1<protocols::ligand_docking::ga_ligand_dock::PlaceableRotamer, std::__1::allocator<protocols::ligand_docking::ga_ligand_dock::PlaceableRotamer>>, std::__1::allocator<utility::vector1<protocols::ligand_docking::ga_ligand_dock::PlaceableRotamer, std::__1::allocator<protocols::ligand_docking::ga_ligand_dock::PlaceableRotamer>>>>&, protocols::ligand_docking::ga_ligand_dock::RotamerPairEnergies&) + 752
13  rosetta_beta_6.06_x86_64-apple-darw 0x000000010575a4b4 protocols::ligand_docking::ga_ligand_dock::GAOptimizer::optimize_generation(utility::vector1<protocols::ligand_docking::ga_ligand_dock::LigandConformer, std::__1::allocator<protocols::ligand_docking::ga_ligand_dock::LigandConformer>>&, utility::vector1<double, std::__1::allocator<double>> const&) + 356
14  rosetta_beta_6.06_x86_64-apple-darw 0x0000000105753e52 protocols::ligand_docking::ga_ligand_dock::GAOptimizer::run(utility::vector1<protocols::ligand_docking::ga_ligand_dock::LigandConformer, std::__1::allocator<protocols::ligand_docking::ga_ligand_dock::LigandConformer>>&) + 2850
15  rosetta_beta_6.06_x86_64-apple-darw 0x000000010577847b protocols::ligand_docking::ga_ligand_dock::GALigandDock::run_docking(protocols::ligand_docking::ga_ligand_dock::LigandConformer const&, std::__1::shared_ptr<protocols::ligand_docking::ga_ligand_dock::GridScorer>, protocols::ligand_docking::ga_ligand_dock::LigandAligner&, protocols::ligand_docking::ga_ligand_dock::OutputStructureStore&) + 715
16  rosetta_beta_6.06_x86_64-apple-darw 0x000000010576e32e protocols::ligand_docking::ga_ligand_dock::GALigandDock::apply(core::pose::Pose&) + 14846
17  rosetta_beta_6.06_x86_64-apple-darw 0x0000000106d5ffd8 protocols::rosetta_scripts::ParsedProtocol::apply_mover(core::pose::Pose&, protocols::rosetta_scripts::ParsedProtocol::ParsedProtocolStep const&) + 1224
18  rosetta_beta_6.06_x86_64-apple-darw 0x0000000106d5862f protocols::rosetta_scripts::ParsedProtocol::apply(core::pose::Pose&) + 1935
19  rosetta_beta_6.06_x86_64-apple-darw 0x0000000106c4522c protocols::jd2::JobDistributor::run_one_job(std::__1::shared_ptr<protocols::moves::Mover>&, long, std::__1::basic_string<char, std::__1::char_traits<char>, std::__1::allocator<char>>&, std::__1::basic_string<char, std::__1::char_traits<char>, std::__1::allocator<char>>&, unsigned long&, unsigned long&, bool) + 8204
20  rosetta_beta_6.06_x86_64-apple-darw 0x0000000106c42572 protocols::jd2::JobDistributor::go_main(std::__1::shared_ptr<protocols::moves::Mover>) + 194
21  rosetta_beta_6.06_x86_64-apple-darw 0x0000000106c3d612 protocols::jd2::FileSystemJobDistributor::go(std::__1::shared_ptr<protocols::moves::Mover>) + 66
22  rosetta_beta_6.06_x86_64-apple-darw 0x0000000106c330e6 protocols::jd2::BOINCJobDistributor::go(std::__1::shared_ptr<protocols::moves::Mover>) + 246
23  rosetta_beta_6.06_x86_64-apple-darw 0x0000000104181254 main + 22020
24  dyld                                0x000000020cb10345 start + 1909
 ------------------------- End developer's backtrace -------------------------- 
======================================================
DONE ::    13 starting structures  28671.3 cpu seconds
This process generated     13 decoys from      13 attempts
======================================================
BOINC :: WS_max 9.78182e+08

BOINC :: Watchdog shutting down...
00:28:31 (50393): called boinc_finish(0)

</stderr_txt>
]]>




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