core.init: (0) Rosetta version: rosetta.source.release-171 r171 2018.09+release.333d9969977 333d99699777cd6a50d1c1736bacd689f8f1d1df https://www.rosettacommons.org 2018-02-27T20:08:15.525183 core.init: (0) command: /home/swillard/Rosetta_3.9_60072/main/source/bin/calibur.mpi.linuxgccrelease -pdb_list pdblist.txt core.init: (0) 'RNG device' seed mode, using '/dev/urandom', seed=-1375975393 seed_offset=0 real_seed=-1375975393 core.init.random: (0) RandomGenerator:init: Normal mode, seed=-1375975393 RG_type=mt19937 core.init: (0) Resolved executable path: /home/swillard/Rosetta_3.9_60072/main/source/build/src/release/linux/4.8/64/x86/gcc/5.4/mpi/calibur.mpi.linuxgccrelease core.init: (0) Looking for database based on location of executable: /home/swillard/Rosetta_3.9_60072/main/database/ Using C-alphas #1-end Filtering on Signature mode off Using chains 'A', 'B', 'C', 'D', 'E', 'F', 'G', 'H', 'I', 'J', 'K', 'L', 'M', 'N', 'O', 'P', 'Q', 'R', 'S', 'T', 'U', 'V', 'W', 'X', 'Y', 'Z', 'a', 'b', 'c', 'd', 'e', 'f', 'g', 'h', 'i', 'j', 'k', 'l', 'm', 'n', 'o', 'p', 'q', 'r', 's', 't', 'u', 'v', 'w', 'x', 'y', 'z', '0', '1', '2', '3', '4', '5', '6', '7', '8', '9', ' ' in PDB files Before names_ assignment Read 9983 decoy names Estimating threshold range... complete Estimated threshold range = [9.66641, 137.85963] Most frequent distance = 21.30353 0.00000 percent distances below 10.67416 Finding threshold to keep 0.00000% edges Threshold = 10.67416 Reading decoys with signature mode off and filter mode on Read 9910 decoys. Filtered 73 outlier decoys. Decoys read in 0.32263 s Initialized 9910 decoys. Use of SCUD's bound on Realigning decoys... completed in 0.07946 s Using MATRIX mode Auxiliary clustering... 100.0% AuxiliaryClustering... completed in 112.99304 s Finding decoys' neighbors... completed 100.0% Finding all neighbors completed in 311.58400 s Finding and removing largest clusters...Removing 1-th (313) in 20's LIST swap with 9 with id 9581 . . . . . . Removing 0-th (4793) in 4483's LIST swap with 0 with id 4793 Removing 0-th (4555) in 4555's LIST swap with 1 with id 5576 Removing 0-th (5576) in 4555's LIST swap with 0 with id 5576 completed in 0.22621 s Largest 2 cluster centers: S_0445_4.pdb(35), S_0001_2.pdb(28). Margin = 20.00000% cluster = 0; center = S_0445_4.pdb; n_decoy_members = 35; members = cluster = 1; center = S_0001_2.pdb; n_decoy_members = 28; members =