start - parameters: File name /home/rpdock/web/media/jobs/64c6590c-39ff-461a-b324-72d5dc660b6f//ref_struc/na-prot_2538/na-prot_2538.pdb Steps 1000 Temp. start 15000.0 Temp. end 295.0 False msg start - parameters: File name /home/rpdock/web/media/jobs/64c6590c-39ff-461a-b324-72d5dc660b6f//ref_struc/na-prot_2538/na-prot_2538.pdb Steps 1000 Temp. start 15000.0 Temp. end 295.0 False Step E Edist Eang Epen Warning, residue G1 in the chain A has not P atom 0 - -2222213.29 -2360141.45 -2262071.84 2400000.00 1 T -2535936.75 -2329095.78 -2206840.97 2000000.00 T= 14970.59 K progress 0.1 2 R -2545357.27 -2341025.38 -2204331.89 2000000.00 T= 14867.655 K progress 0.2 3 T -2506503.83 -2378592.30 -2227911.53 2100000.00 T= 14411.8 K progress 0.3 4 R -2355815.60 -2430765.29 -2225050.30 2300000.00 T= 14352.98 K progress 0.4 5 R -2432778.12 -2397845.11 -2234933.01 2200000.00 T= 14235.34 K progress 0.5 6 R -2556496.90 -2405307.20 -2251189.69 2100000.00 T= 14176.52 K progress 0.6 7 R -2387718.81 -2376075.46 -2211643.35 2200000.00 T= 12970.71 K progress 0.7 8 R -2159413.68 -2345379.97 -2214033.71 2400000.00 T= 12956.005 K progress 0.8 9 R -2555376.43 -2404186.74 -2251189.69 2100000.00 T= 12941.3 K progress 0.9 10 T -2446234.32 -2404941.24 -2241293.07 2200000.00 T= 12588.38 K progress 1.0 11 R -2456287.16 -2406736.50 -2249550.66 2200000.00 T= 12470.74 K progress 1.1 12 R -2422234.78 -2390186.27 -2232048.51 2200000.00 T= 12191.345 K progress 1.2 13 R -2404179.52 -2382079.43 -2222100.09 2200000.00 T= 11544.325 K progress 1.3 14 R -2498266.88 -2368368.96 -2229897.92 2100000.00 T= 11294.34 K progress 1.4 15 R -2473224.91 -2362218.87 -2211006.04 2100000.00 T= 11161.995 K progress 1.5 16 R -2594184.06 -2435939.23 -2258244.83 2100000.00 T= 10985.535 K progress 1.6 17 R -2587011.84 -2432435.54 -2254576.30 2100000.00 T= 9294.46 K progress 1.7 18 R -2556256.50 -2388237.65 -2268018.85 2100000.00 T= 8294.52 K progress 1.8 19 T -2550770.63 -2199404.04 -2051366.59 1700000.00 T= 8132.765 K progress 1.9 20 R -2516801.58 -2198890.77 -2017910.81 1700000.00 T= 7632.795 K progress 2.0 21 R -2669512.48 -2224762.93 -2044749.55 1600000.00 T= 7456.335 K progress 2.1 22 T -2633218.41 -2212075.18 -2021143.23 1600000.00 T= 5368.225 K progress 2.2 23 R -2624409.41 -2203787.35 -2020622.06 1600000.00 T= 5338.815 K progress 2.3 24 R -2625244.09 -2206442.88 -2018801.21 1600000.00 T= 5118.24 K progress 2.4 25 R -2609578.19 -2201936.33 -2007641.86 1600000.00 T= 4544.745 K progress 2.5 26 R -2584441.00 -2040033.96 -1944407.04 1400000.00 T= 4368.285 K progress 2.6 27 R -2524927.01 -2120713.93 -2004213.08 1600000.00 T= 4088.89 K progress 2.7 28 R -2590720.16 -2044814.65 -1945905.51 1400000.00 T= 4015.365 K progress 2.8 29 R -2590036.59 -2044814.65 -1945221.95 1400000.00 T= 3927.135 K progress 2.9 30 T -2830569.58 -2129401.03 -2001168.55 1300000.00 T= 3868.315 K progress 3.0 31 R -2828200.31 -2126271.84 -2001928.46 1300000.00 T= 3780.085 K progress 3.1 32 R -2849075.65 -2140163.01 -2008912.64 1300000.00 T= 2853.67 K progress 3.2 33 R -2849075.65 -2140163.01 -2008912.64 1300000.00 T= 2588.98 K progress 3.3 34 R -2849075.65 -2140163.01 -2008912.64 1300000.00 T= 2294.88 K progress 3.4 35 R -2852633.18 -2141076.14 -2011557.04 1300000.00 T= 971.43 K progress 3.5 36 T -2995636.68 -2154148.30 -2041488.38 1200000.00 T= 750.855 K progress 3.6 37 R -2995331.06 -2153842.68 -2041488.38 1200000.00 T= 574.395 K progress 3.7 Save no big msg save short traj msg save best.pdb msg save plot e_step.png