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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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LDB: ============= START OF LOAD BALANCING ============== 54.6409
LDB: Largest compute 200 load 0.434408 is 1.2% of average load 36.841619
LDB: Average compute 0.051607 is 0.1% of average load 36.841619
LDB: Partitioning computes with target load 3.684162
LDB: Increased migratable compute count from 2736 to 2736
LDB: Largest unpartitionable compute is 0.055845
LDB: ============== END OF LOAD BALANCING =============== 54.643
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 54.6439
Info: Initial time: 4 CPUs 0.474759 s/step 5.4949 days/ns 3221.52 MB memory
TIMING: 100 CPU: 48.4471, 0.473851/step Wall: 48.4471, 0.473851/step, 0.0526502 hours remaining, 3221.523438 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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LDB: ============= START OF LOAD BALANCING ============== 64.1038
LDB: ============== END OF LOAD BALANCING =============== 64.1039
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 64.1043
TIMING: 120 CPU: 57.9072, 0.473004/step Wall: 57.9072, 0.473004/step, 0.0499282 hours remaining, 3221.652344 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ENERGY: 138 21874.8525 19195.4802 5730.8549 192.8766 -333203.4343 21083.5324 0.0000 0.0000 42784.9638 -222340.8738 155.6399 -265125.8377 -222213.1815 155.6399 -2704.7054 -2927.3525 921491.4634 -2704.7054 -2927.3525
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TIMING: 140 CPU: 67.3599, 0.472635/step Wall: 67.3599, 0.472635/step, 0.0472635 hours remaining, 3221.953125 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 140 20992.5976 17997.1578 5722.1741 192.2140 -333726.9441 21127.4061 0.0000 0.0000 45144.2513 -222551.1432 164.2224 -267695.3945 -222224.0361 164.2224 -5617.7627 -3080.3638 921491.4634 -5617.7627 -3080.3638
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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TIMING: 160 CPU: 76.7997, 0.471991/step Wall: 76.7997, 0.471991/step, 0.0445769 hours remaining, 3222.093750 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ENERGY: 178 21917.7900 18733.9559 5737.6245 154.5770 -332975.2976 21015.2133 0.0000 0.0000 43101.1544 -222314.9824 156.7902 -265416.1368 -222126.1321 156.7902 -2936.2256 -2665.7682 921491.4634 -2936.2256 -2665.7682
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TIMING: 180 CPU: 86.2301, 0.471521/step Wall: 86.2301, 0.471521/step, 0.041913 hours remaining, 3222.234375 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ENERGY: 186 19266.0406 19234.9571 5686.4352 181.9571 -332240.0938 21043.7459 0.0000 0.0000 44391.5886 -222435.3693 161.4844 -266826.9579 -222129.2889 161.4844 -2596.4732 -2731.4263 921491.4634 -2596.4732 -2731.4263
ENERGY: 187 22073.2968 19471.4303 5678.7398 184.6336 -333156.1128 21076.9265 0.0000 0.0000 42449.0055 -222222.0802 154.4178 -264671.0857 -222130.9081 154.4178 -3641.8536 -2802.0867 921491.4634 -3641.8536 -2802.0867
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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LDB: ============= START OF LOAD BALANCING ============== 101.858
LDB: Largest compute 200 load 0.429719 is 1.2% of average load 36.660865
LDB: Average compute 0.051352 is 0.1% of average load 36.660865
LDB: TIME 101.859 LOAD: AVG 36.6609 MAX 37.7531 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3222.55 MB
LDB: TIME 101.862 LOAD: AVG 36.6609 MAX 37.6574 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 TorusLB MEM: 3222.55 MB
LDB: ============== END OF LOAD BALANCING =============== 101.863
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 101.867
Info: Initial time: 4 CPUs 0.472085 s/step 5.46395 days/ns 3223.52 MB memory
TIMING: 200 CPU: 95.6655, 0.471768/step Wall: 95.6655, 0.471768/step, 0.039314 hours remaining, 3223.519531 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ENERGY: 203 20743.8944 19130.0391 5729.2400 192.0764 -333501.9371 21215.8253 0.0000 0.0000 44059.6986 -222431.1633 160.2771 -266490.8619 -222093.6426 160.2771 -1046.8257 -2512.4435 921491.4634 -1046.8257 -2512.4435
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ENERGY: 208 20293.2703 20371.8903 5718.1572 182.8654 -334789.2381 21322.2409 0.0000 0.0000 44428.6271 -222472.1868 161.6191 -266900.8139 -222122.6317 161.6191 -3669.0644 -2719.7953 921491.4634 -3669.0644 -2719.7953
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 210 21385.1734 20194.2569 5705.3139 178.4614 -336615.7771 21385.1095 0.0000 0.0000 45251.4335 -222516.0285 164.6123 -267767.4619 -222108.2019 164.6123 -6091.3664 -2896.2628 921491.4634 -6091.3664 -2896.2628
ENERGY: 211 24099.1928 19985.8632 5704.9373 176.9105 -336667.8930 21415.1477 0.0000 0.0000 43031.7285 -222254.1131 156.5376 -265285.8416 -222106.8544 156.5376 -5900.2978 -2885.1011 921491.4634 -5900.2978 -2885.1011
ENERGY: 212 23739.2709 19730.8223 5710.0295 176.0352 -336013.6225 21412.5982 0.0000 0.0000 42995.1638 -222249.7026 156.4046 -265244.8663 -222104.2318 156.4046 -4424.1002 -2820.3210 921491.4634 -4424.1002 -2820.3210
ENERGY: 213 20150.2159 19524.5249 5720.1722 175.9508 -334874.6441 21380.5551 0.0000 0.0000 45418.7805 -222504.4447 165.2210 -267923.2252 -222097.3834 165.2210 -2174.3116 -2725.0841 921491.4634 -2174.3116 -2725.0841
ENERGY: 214 17315.5528 19421.7448 5733.3059 176.6827 -333645.3933 21358.4485 0.0000 0.0000 46958.4702 -222681.1885 170.8220 -269639.6586 -222093.7407 170.8220 -143.6684 -2626.0578 921491.4634 -143.6684 -2626.0578
ENERGY: 215 18210.5055 19441.9743 5746.5772 178.1492 -332787.3320 21379.5596 0.0000 0.0000 45302.6745 -222527.8916 164.7987 -267830.5661 -222091.0447 164.7987 784.0015 -2554.0368 921491.4634 784.0015 -2554.0368
ENERGY: 216 20973.4717 19522.5061 5756.9571 180.1770 -332560.1062 21436.4835 0.0000 0.0000 42442.1787 -222248.3320 154.3930 -264690.5107 -222073.6158 154.3930 420.9901 -2541.5428 921491.4634 420.9901 -2541.5428
ENERGY: 217 21778.3867 19581.4819 5762.2416 182.5517 -333010.6759 21497.2705 0.0000 0.0000 41983.6750 -222225.0685 152.7251 -264208.7435 -222064.4467 152.7251 -882.1700 -2598.7243 921491.4634 -882.1700 -2598.7243
ENERGY: 218 20165.9157 19540.0890 5761.2415 184.9927 -333856.1149 21546.6561 0.0000 0.0000 44178.6836 -222478.5363 160.7099 -266657.2199 -222068.8157 160.7099 -2628.0653 -2703.9746 921491.4634 -2628.0653 -2703.9746
ENERGY: 219 19429.8641 19413.3931 5754.3577 187.2447 -334778.0710 21596.8808 0.0000 0.0000 45751.9297 -222644.4010 166.4329 -268396.3307 -222073.1722 166.4329 -4457.7333 -2810.5237 921491.4634 -4457.7333 -2810.5237
TIMING: 220 CPU: 105.113, 0.472354/step Wall: 105.113, 0.472354/step, 0.0367387 hours remaining, 3223.519531 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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TIMING: 240 CPU: 114.549, 0.471829/step Wall: 114.549, 0.471829/step, 0.0340765 hours remaining, 3223.519531 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ENERGY: 246 20878.5480 19853.7024 5716.8932 174.1558 -334213.1202 21705.0850 0.0000 0.0000 43600.4181 -222284.3178 158.6063 -265884.7359 -222067.4295 158.6063 -1173.7929 -2523.3911 921491.4634 -1173.7929 -2523.3911
ENERGY: 247 19868.5286 19979.6440 5712.7400 177.5412 -334802.1839 21719.8454 0.0000 0.0000 44912.1911 -222431.6936 163.3782 -267343.8848 -222068.1393 163.3782 -983.0000 -2552.5930 921491.4634 -983.0000 -2552.5930
ENERGY: 248 19035.4925 20164.4296 5713.8450 181.3144 -335623.1352 21746.4310 0.0000 0.0000 46185.9361 -222595.6866 168.0117 -268781.6227 -222090.3128 168.0117 -1359.1247 -2608.3065 921491.4634 -1359.1247 -2608.3065
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ENERGY: 256 20899.4409 18950.9577 5693.4518 195.6570 -332975.5970 21757.6847 0.0000 0.0000 43181.1613 -222297.2436 157.0812 -265478.4049 -222071.2738 157.0812 -2042.2408 -2664.5198 921491.4634 -2042.2408 -2664.5198
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TIMING: 260 CPU: 123.978, 0.471441/step Wall: 123.978, 0.471441/step, 0.0314294 hours remaining, 3223.867188 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ENERGY: 263 19781.1228 20140.5621 5703.8103 187.9445 -335614.9712 21924.4739 0.0000 0.0000 45349.7771 -222527.2804 164.9700 -267877.0575 -222051.1547 164.9700 -2647.8115 -2773.3903 921491.4634 -2647.8115 -2773.3903
ENERGY: 264 19385.2260 20436.4304 5710.6950 187.5052 -334855.9511 21907.7771 0.0000 0.0000 44751.4784 -222476.8389 162.7936 -267228.3173 -222069.1984 162.7936 -2191.1926 -2723.5294 921491.4634 -2191.1926 -2723.5294
ENERGY: 265 19946.8414 20681.9925 5713.6242 187.4392 -334395.6631 21906.0162 0.0000 0.0000 43607.6375 -222352.1121 158.6326 -265959.7496 -222054.3372 158.6326 -2038.0573 -2683.6035 921491.4634 -2038.0573 -2683.6035
ENERGY: 266 20048.7898 20788.8700 5712.1327 187.6137 -334399.4576 21914.4804 0.0000 0.0000 43399.3797 -222348.1913 157.8750 -265747.5710 -222054.3635 157.8750 -2130.7241 -2664.5957 921491.4634 -2130.7241 -2664.5957
ENERGY: 267 19648.0905 20691.2678 5707.0583 187.8501 -334831.4855 21930.8373 0.0000 0.0000 44220.2168 -222446.1646 160.8610 -266666.3814 -222055.6585 160.8610 -2435.4236 -2662.6783 921491.4634 -2435.4236 -2662.6783
ENERGY: 268 19962.9161 20375.7516 5700.1930 187.9286 -335513.7448 21959.1257 0.0000 0.0000 44823.5376 -222504.2923 163.0557 -267327.8299 -222075.9874 163.0557 -2903.2126 -2658.6181 921491.4634 -2903.2126 -2658.6181
ENERGY: 269 21396.7814 19927.1703 5694.0390 187.7639 -336221.0660 21997.2160 0.0000 0.0000 44586.5098 -222431.5857 162.1935 -267018.0955 -222066.1972 162.1935 -3401.4130 -2647.2950 921491.4634 -3401.4130 -2647.2950
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 270 22620.1933 19450.9168 5690.3173 187.1618 -336650.6773 22028.8070 0.0000 0.0000 44308.0075 -222365.2737 161.1804 -266673.2812 -222067.0433 161.1804 -3583.3634 -2617.7583 921491.4634 -3583.3634 -2617.7583
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ENERGY: 272 21021.5584 18896.0661 5692.8269 184.9335 -335921.4614 22015.0579 0.0000 0.0000 45607.7077 -222503.3109 165.9083 -268111.0186 -222081.1571 165.9083 -2551.9684 -2501.8805 921491.4634 -2551.9684 -2501.8805
ENERGY: 273 20123.2136 18932.9080 5697.5118 183.8526 -334925.7011 21985.5295 0.0000 0.0000 45502.7162 -222499.9695 165.5264 -268002.6856 -222069.0458 165.5264 -1837.1975 -2434.6760 921491.4634 -1837.1975 -2434.6760
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ENERGY: 276 19401.8501 19594.7509 5701.2547 182.4904 -333292.1281 21971.0409 0.0000 0.0000 44028.5272 -222412.2139 160.1637 -266440.7412 -222072.9394 160.1637 -1580.1300 -2417.6041 921491.4634 -1580.1300 -2417.6041
ENERGY: 277 19149.2972 19724.7161 5695.5210 182.9396 -333864.3453 21997.2386 0.0000 0.0000 44632.8112 -222481.8217 162.3619 -267114.6328 -222061.0987 162.3619 -2311.7545 -2498.0545 921491.4634 -2311.7545 -2498.0545
ENERGY: 278 20199.4577 19713.7761 5686.9122 183.6585 -334821.1003 22041.3358 0.0000 0.0000 44532.2540 -222463.7060 161.9961 -266995.9600 -222063.4130 161.9961 -3254.8157 -2593.7696 921491.4634 -3254.8157 -2593.7696
ENERGY: 279 21984.3649 19593.9432 5677.5176 184.5187 -335888.5800 22096.4198 0.0000 0.0000 43975.0880 -222376.7278 159.9693 -266351.8158 -222065.2023 159.9693 -4044.3213 -2682.8389 921491.4634 -4044.3213 -2682.8389
TIMING: 280 CPU: 133.391, 0.470657/step Wall: 133.391, 0.470657/step, 0.0287624 hours remaining, 3223.867188 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 280 22859.3230 19458.4367 5670.0026 185.3899 -336752.6633 22145.1353 0.0000 0.0000 44066.7339 -222367.6419 160.3027 -266434.3758 -222073.4247 160.3027 -4286.3893 -2748.0546 921491.4634 -4286.3893 -2748.0546
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ENERGY: 282 20943.7898 19615.5379 5669.9796 186.8360 -336942.5035 22176.7653 0.0000 0.0000 45823.3371 -222526.2578 166.6927 -268349.5949 -222063.3316 166.6927 -2992.3271 -2779.3668 921491.4634 -2992.3271 -2779.3668
ENERGY: 283 20432.1060 19966.6614 5678.8137 187.1634 -336251.9201 22171.0647 0.0000 0.0000 45328.8522 -222487.2587 164.8939 -267816.1109 -222060.8460 164.8939 -2008.7736 -2748.2306 921491.4634 -2008.7736 -2748.2306
ENERGY: 284 20506.3999 20401.8821 5692.0830 187.1346 -335412.6297 22166.2908 0.0000 0.0000 44071.4481 -222387.3911 160.3198 -266458.8392 -222061.5537 160.3198 -1267.2790 -2712.3901 921491.4634 -1267.2790 -2712.3901
ENERGY: 285 20203.3287 20789.9629 5707.3565 186.7145 -334827.1962 22167.0165 0.0000 0.0000 43418.2632 -222354.5542 157.9437 -265772.8173 -222053.5963 157.9437 -1010.8437 -2700.0819 921491.4634 -1010.8437 -2700.0819
ENERGY: 286 19396.6309 20966.5622 5721.5032 185.8229 -334658.1145 22176.6862 0.0000 0.0000 43785.6883 -222425.2209 159.2803 -266210.9091 -222054.0579 159.2803 -1306.7501 -2717.2846 921491.4634 -1306.7501 -2717.2846
ENERGY: 287 19176.1190 20856.7823 5731.9346 184.4714 -334918.1477 22200.2909 0.0000 0.0000 44282.9438 -222485.6056 161.0892 -266768.5494 -222055.7250 161.0892 -2148.9612 -2753.3343 921491.4634 -2148.9612 -2753.3343
ENERGY: 288 20263.2088 20475.2852 5736.9557 182.7335 -335468.3149 22237.9036 0.0000 0.0000 44116.9905 -222455.2376 160.4855 -266572.2281 -222066.9054 160.4855 -3310.5880 -2790.1554 921491.4634 -3310.5880 -2790.1554
ENERGY: 289 21886.4834 19928.6979 5736.1905 180.7560 -336126.9123 22279.0689 0.0000 0.0000 43733.4514 -222382.2642 159.0903 -266115.7156 -222062.2725 159.0903 -4368.9815 -2809.8750 921491.4634 -4368.9815 -2809.8750
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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LDB: ============= START OF LOAD BALANCING ============== 149.017
LDB: Largest compute 200 load 0.524838 is 1.1% of average load 45.781358
LDB: Average compute 0.064134 is 0.1% of average load 45.781358
LDB: TIME 149.019 LOAD: AVG 45.7814 MAX 47.1509 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3224.29 MB
LDB: TIME 149.02 LOAD: AVG 45.7814 MAX 47.1509 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 RefineTorusLB MEM: 3224.29 MB
LDB: TIME 149.025 LOAD: AVG 45.7814 MAX 46.1401 PROXIES: TOTAL 115 MAXPE 31 MAXPATCH 2 RefineTorusLB MEM: 3224.29 MB
LDB: ============== END OF LOAD BALANCING =============== 149.026
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 149.027
Info: Initial time: 4 CPUs 0.471156 s/step 5.4532 days/ns 3224.29 MB memory
TIMING: 300 CPU: 142.791, 0.469984/step Wall: 142.791, 0.469985/step, 0.0261103 hours remaining, 3224.289062 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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TIMING: 320 CPU: 151.98, 0.459478/step Wall: 151.98, 0.459478/step, 0.0229739 hours remaining, 3224.289062 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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TIMING: 340 CPU: 161.159, 0.458951/step Wall: 161.159, 0.458951/step, 0.0203978 hours remaining, 3224.289062 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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TIMING: 360 CPU: 170.335, 0.458772/step Wall: 170.335, 0.458772/step, 0.0178411 hours remaining, 3224.289062 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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TIMING: 380 CPU: 179.503, 0.458418/step Wall: 179.503, 0.458418/step, 0.0152806 hours remaining, 3224.289062 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ENERGY: 384 19625.4111 19596.0353 5710.5350 179.0647 -336052.0487 22884.2538 0.0000 0.0000 45539.1830 -222517.5659 165.6590 -268056.7489 -222062.0926 165.6590 -569.2377 -2166.9356 921491.4634 -569.2377 -2166.9356
ENERGY: 385 19327.8178 19356.8911 5707.7752 177.4354 -335210.6402 22871.6148 0.0000 0.0000 45299.7168 -222469.3890 164.7879 -267769.1058 -222051.0994 164.7879 215.3517 -2064.3635 921491.4634 215.3517 -2064.3635
ENERGY: 386 19981.2272 19220.9464 5707.6638 175.9384 -334865.1819 22880.7962 0.0000 0.0000 44519.8583 -222378.7516 161.9510 -266898.6099 -222051.0438 161.9510 122.6672 -2011.2426 921491.4634 122.6672 -2011.2426
ENERGY: 387 20367.2860 19202.4843 5710.9355 174.6759 -335109.8729 22905.2749 0.0000 0.0000 44377.1813 -222372.0350 161.4320 -266749.2163 -222053.0051 161.4320 -738.9583 -2019.1687 921491.4634 -738.9583 -2019.1687
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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LDB: ============= START OF LOAD BALANCING ============== 194.917
LDB: Largest compute 230 load 0.531014 is 1.2% of average load 45.756312
LDB: Average compute 0.064036 is 0.1% of average load 45.756312
LDB: TIME 194.919 LOAD: AVG 45.7563 MAX 45.8864 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3224.29 MB
LDB: TIME 194.919 LOAD: AVG 45.7563 MAX 45.8864 PROXIES: TOTAL 115 MAXPE 31 MAXPATCH 2 RefineTorusLB MEM: 3224.29 MB
LDB: TIME 194.919 LOAD: AVG 45.7563 MAX 45.8864 PROXIES: TOTAL 115 MAXPE 31 MAXPATCH 2 RefineTorusLB MEM: 3224.29 MB
LDB: ============== END OF LOAD BALANCING =============== 194.92
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 194.921
Info: Benchmark time: 4 CPUs 0.45884 s/step 5.31065 days/ns 3224.29 MB memory
TIMING: 400 CPU: 188.679, 0.458786/step Wall: 188.679, 0.458786/step, 0.0127441 hours remaining, 3224.289062 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ENERGY: 402 22444.0480 19835.9108 5715.8942 173.8391 -338107.6289 23109.6383 0.0000 0.0000 44436.8094 -222391.4891 161.6489 -266828.2985 -222049.2227 161.6489 -4939.3795 -2681.7024 921491.4634 -4939.3795 -2681.7024
ENERGY: 403 20784.9693 19778.4827 5715.7218 174.2695 -337239.9784 23077.8406 0.0000 0.0000 45225.5959 -222483.0985 164.5183 -267708.6944 -222046.6855 164.5183 -3613.5977 -2605.7428 921491.4634 -3613.5977 -2605.7428
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ENERGY: 408 19735.8469 19387.6644 5692.2152 187.5226 -335902.8217 23017.8176 0.0000 0.0000 45394.4120 -222487.3430 165.1324 -267881.7550 -222063.5309 165.1324 -920.8281 -2294.1555 921491.4634 -920.8281 -2294.1555
ENERGY: 409 20350.1189 19376.4607 5688.4775 191.1593 -336896.6846 23057.9925 0.0000 0.0000 45733.6057 -222498.8701 166.3663 -268232.4758 -222051.6702 166.3663 -2367.4920 -2346.9324 921491.4634 -2367.4920 -2346.9324
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ENERGY: 415 19745.2666 20572.1258 5708.7452 198.1487 -336456.1970 23071.1991 0.0000 0.0000 44733.2273 -222427.4844 162.7272 -267160.7116 -222049.0345 162.7272 -1174.6451 -2266.5615 921491.4634 -1174.6451 -2266.5615
ENERGY: 416 19942.3169 20661.9894 5710.0857 195.6953 -336157.5859 23063.1714 0.0000 0.0000 44200.2850 -222384.0420 160.7885 -266584.3271 -222052.9643 160.7885 -282.7612 -2224.6897 921491.4634 -282.7612 -2224.6897
ENERGY: 417 20031.3748 20631.3207 5709.0494 192.4696 -336373.1072 23072.1097 0.0000 0.0000 44338.4621 -222398.3209 161.2911 -266736.7830 -222044.6993 161.2911 -112.4553 -2227.1699 921491.4634 -112.4553 -2227.1699
ENERGY: 418 20154.6647 20457.0907 5705.5848 188.6536 -336970.7865 23098.6724 0.0000 0.0000 44915.1424 -222450.9778 163.3889 -267366.1202 -222046.7092 163.3889 -671.8546 -2269.9921 921491.4634 -671.8546 -2269.9921
ENERGY: 419 20790.7633 20185.5522 5700.4811 184.6054 -337717.8754 23139.8021 0.0000 0.0000 45250.3101 -222466.3613 164.6082 -267716.6713 -222049.5950 164.6082 -1783.9423 -2336.6465 921491.4634 -1783.9423 -2336.6465
TIMING: 420 CPU: 197.822, 0.45716/step Wall: 197.822, 0.45716/step, 0.0101591 hours remaining, 3224.289062 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ENERGY: 432 21768.3701 20188.6726 5710.3547 168.1086 -338651.2096 23176.0839 0.0000 0.0000 45177.9913 -222461.6285 164.3451 -267639.6198 -222065.9058 164.3451 -3350.2744 -2296.1500 921491.4634 -3350.2744 -2296.1500
ENERGY: 433 21200.9069 20275.9665 5710.3764 168.4633 -338164.0632 23162.2904 0.0000 0.0000 45192.9286 -222453.1311 164.3995 -267646.0597 -222052.5982 164.3995 -3187.3734 -2272.1278 921491.4634 -3187.3734 -2272.1278
ENERGY: 434 20730.3412 20338.1500 5711.6061 169.3247 -337394.2699 23140.7729 0.0000 0.0000 44883.0998 -222420.9751 163.2724 -267304.0750 -222051.1462 163.2724 -2694.3109 -2227.7887 921491.4634 -2694.3109 -2227.7887
ENERGY: 435 20235.2201 20362.4015 5714.0003 170.8455 -336680.6550 23123.4092 0.0000 0.0000 44675.9840 -222398.7944 162.5190 -267074.7784 -222049.5889 162.5190 -2061.3583 -2179.8953 921491.4634 -2061.3583 -2179.8953
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TIMING: 440 CPU: 206.958, 0.45679/step Wall: 206.958, 0.45679/step, 0.00761317 hours remaining, 3224.289062 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 440 22071.5686 20036.2372 5729.7527 186.7202 -338123.1805 23276.2483 0.0000 0.0000 44417.5456 -222405.1080 161.5788 -266822.6535 -222059.4774 161.5788 -2408.4615 -2197.9673 921491.4634 -2408.4615 -2197.9673
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ENERGY: 442 21853.6115 19664.5349 5729.4855 192.9412 -338090.1529 23327.1566 0.0000 0.0000 44880.6319 -222441.7915 163.2634 -267322.4233 -222049.7756 163.2634 -2710.5577 -2229.0697 921491.4634 -2710.5577 -2229.0697
ENERGY: 443 21064.3314 19487.0722 5727.6165 194.9329 -337369.3146 23320.0156 0.0000 0.0000 45118.1104 -222457.2355 164.1273 -267575.3459 -222048.5997 164.1273 -2448.1648 -2220.3532 921491.4634 -2448.1648 -2220.3532
ENERGY: 444 20449.3363 19357.2689 5725.4095 195.8735 -336464.1917 23301.5275 0.0000 0.0000 44987.7172 -222447.0588 163.6530 -267434.7760 -222057.9798 163.6530 -2090.2099 -2206.4400 921491.4634 -2090.2099 -2206.4400
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ENERGY: 446 19947.6803 19324.9005 5722.5430 194.3235 -335494.5705 23276.0450 0.0000 0.0000 44620.2943 -222408.7839 162.3164 -267029.0782 -222046.1621 162.3164 -1800.7518 -2216.7294 921491.4634 -1800.7518 -2216.7294
ENERGY: 447 19914.2847 19416.0210 5722.2107 191.8641 -335769.4398 23282.7457 0.0000 0.0000 44816.5085 -222425.8050 163.0301 -267242.3136 -222046.8343 163.0301 -1993.3113 -2253.0603 921491.4634 -1993.3113 -2253.0603
ENERGY: 448 20187.5923 19583.6801 5722.5765 188.5554 -336503.1801 23303.8903 0.0000 0.0000 45065.6670 -222451.2186 163.9365 -267516.8856 -222059.3482 163.9365 -2372.1880 -2303.7899 921491.4634 -2372.1880 -2303.7899
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ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 450 21754.4855 20108.1300 5724.4776 181.0897 -338419.3250 23364.6241 0.0000 0.0000 44854.3093 -222432.2087 163.1676 -267286.5180 -222048.7862 163.1676 -3116.6758 -2394.3897 921491.4634 -3116.6758 -2394.3897
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ENERGY: 452 22246.2012 20536.0133 5723.8953 174.8859 -338927.1537 23378.0941 0.0000 0.0000 44452.9196 -222415.1441 161.7075 -266868.0638 -222059.6372 161.7075 -2659.9605 -2384.7568 921491.4634 -2659.9605 -2384.7568
ENERGY: 453 21399.8725 20641.1309 5722.2878 173.1350 -338392.7933 23354.5905 0.0000 0.0000 44683.7033 -222418.0732 162.5470 -267101.7764 -222043.5373 162.5470 -2048.3338 -2342.4668 921491.4634 -2048.3338 -2342.4668
ENERGY: 454 20248.3382 20654.1372 5720.2217 172.3637 -337567.1413 23320.6899 0.0000 0.0000 45008.1463 -222443.2443 163.7273 -267451.3906 -222041.8393 163.7273 -1453.4578 -2293.1450 921491.4634 -1453.4578 -2293.1450
ENERGY: 455 19486.7907 20584.7118 5718.4844 172.5169 -336790.6451 23290.4021 0.0000 0.0000 45086.5787 -222451.1605 164.0126 -267537.7392 -222040.8571 164.0126 -1151.8824 -2255.8572 921491.4634 -1151.8824 -2255.8572
ENERGY: 456 19493.3720 20440.6798 5717.7556 173.4248 -336350.1074 23274.9629 0.0000 0.0000 44811.4726 -222438.4397 163.0118 -267249.9123 -222055.3487 163.0118 -1305.5005 -2245.5823 921491.4634 -1305.5005 -2245.5823
ENERGY: 457 20047.4929 20251.9433 5718.5580 174.9241 -336395.8164 23277.8272 0.0000 0.0000 44521.8704 -222403.2004 161.9583 -266925.0708 -222049.4134 161.9583 -1906.4167 -2263.5014 921491.4634 -1906.4167 -2263.5014
ENERGY: 458 20585.8438 20019.2722 5720.7061 176.6081 -336835.0958 23294.7170 0.0000 0.0000 44632.7886 -222405.1600 162.3618 -267037.9487 -222051.2824 162.3618 -2684.6990 -2301.0428 921491.4634 -2684.6990 -2301.0428
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TIMING: 460 CPU: 216.103, 0.457282/step Wall: 216.103, 0.457282/step, 0.00508091 hours remaining, 3224.289062 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
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ENERGY: 462 22264.2254 19487.8108 5736.4822 180.9531 -337988.7165 23351.1083 0.0000 0.0000 44559.9292 -222408.2075 162.0968 -266968.1367 -222056.7215 162.0968 -2954.8200 -2323.4252 921491.4634 -2954.8200 -2323.4252
ENERGY: 463 21821.1791 19513.9014 5738.9361 181.1160 -337284.1022 23326.9474 0.0000 0.0000 44313.4570 -222388.5653 161.2002 -266702.0223 -222054.6243 161.2002 -2012.4424 -2264.0780 921491.4634 -2012.4424 -2264.0780
ENERGY: 464 20535.2460 19559.9271 5739.2518 181.0096 -336389.3835 23291.1938 0.0000 0.0000 44654.0266 -222428.7286 162.4391 -267082.7552 -222058.5731 162.4391 -1050.9228 -2205.5271 921491.4634 -1050.9228 -2205.5271
ENERGY: 465 19322.7826 19631.8854 5737.2898 180.7155 -335701.1530 23259.7387 0.0000 0.0000 45094.5689 -222474.1721 164.0416 -267568.7410 -222052.9390 164.0416 -512.3349 -2174.4011 921491.4634 -512.3349 -2174.4011
ENERGY: 466 19088.4509 19708.3582 5733.2107 180.2808 -335443.7723 23245.0599 0.0000 0.0000 45020.7911 -222467.6208 163.7733 -267488.4119 -222052.9787 163.7733 -630.3318 -2182.6713 921491.4634 -630.3318 -2182.6713
ENERGY: 467 19841.8070 19783.1743 5727.6703 179.7757 -335721.0950 23249.4525 0.0000 0.0000 44523.6667 -222415.5484 161.9649 -266939.2152 -222054.3497 161.9649 -1393.6035 -2232.5927 921491.4634 -1393.6035 -2232.5927
ENERGY: 468 20761.8485 19845.4943 5721.5089 179.2779 -336451.5665 23265.8121 0.0000 0.0000 44291.6586 -222385.9663 161.1209 -266677.6249 -222056.3591 161.1209 -2508.6720 -2314.1343 921491.4634 -2508.6720 -2314.1343
ENERGY: 469 21236.3019 19910.2022 5715.6824 178.8504 -337458.3202 23284.3957 0.0000 0.0000 44720.3204 -222412.5672 162.6802 -267132.8877 -222046.0750 162.6802 -3596.7411 -2405.7975 921491.4634 -3596.7411 -2405.7975
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 470 21411.1731 19972.8934 5710.9491 178.5947 -338383.2508 23297.0667 0.0000 0.0000 45346.4580 -222466.1156 164.9580 -267812.5736 -222047.6088 164.9580 -4259.6999 -2477.6834 921491.4634 -4259.6999 -2477.6834
ENERGY: 471 21732.8676 20054.6835 5707.9626 178.5890 -338913.2452 23297.5080 0.0000 0.0000 45471.3375 -222470.2971 165.4122 -267941.6345 -222047.5359 165.4122 -4290.5685 -2504.3178 921491.4634 -4290.5685 -2504.3178
ENERGY: 472 22081.2359 20161.5551 5707.0091 178.9047 -338870.6767 23279.4486 0.0000 0.0000 45028.5305 -222433.9929 163.8014 -267462.5234 -222059.5058 163.8014 -3659.7362 -2479.9187 921491.4634 -3659.7362 -2479.9187
ENERGY: 473 21866.1362 20289.3425 5707.9843 179.6165 -338307.7192 23240.7359 0.0000 0.0000 44634.5180 -222389.3859 162.3681 -267023.9039 -222043.8539 162.3681 -2556.3617 -2408.1660 921491.4634 -2556.3617 -2408.1660
ENERGY: 474 20842.9704 20372.0985 5710.2160 180.7466 -337438.4555 23189.2344 0.0000 0.0000 44733.2314 -222409.9581 162.7272 -267143.1895 -222041.2619 162.7272 -1295.5526 -2316.2731 921491.4634 -1295.5526 -2316.2731
ENERGY: 475 19674.2079 20371.7674 5712.9876 182.2512 -336604.2318 23142.3814 0.0000 0.0000 45070.2147 -222450.4216 163.9531 -267520.6363 -222039.4530 163.9531 -344.6451 -2232.2128 921491.4634 -344.6451 -2232.2128
ENERGY: 476 19235.7861 20282.0275 5715.7683 184.0125 -336100.0909 23115.8463 0.0000 0.0000 45106.0642 -222460.5860 164.0835 -267566.6502 -222053.6137 164.0835 -92.4052 -2183.0654 921491.4634 -92.4052 -2183.0654
ENERGY: 477 19704.7251 20145.9814 5718.4976 185.9230 -336101.8796 23114.2937 0.0000 0.0000 44812.3215 -222420.1374 163.0149 -267232.4588 -222044.8410 163.0149 -667.4949 -2171.8229 921491.4634 -667.4949 -2171.8229
ENERGY: 478 20493.4779 19974.7639 5721.0254 187.7262 -336537.4043 23131.2458 0.0000 0.0000 44627.0337 -222402.1313 162.3409 -267029.1651 -222047.4106 162.3409 -1807.1607 -2198.7956 921491.4634 -1807.1607 -2198.7956
ENERGY: 479 21125.3059 19793.3957 5723.3295 189.2099 -337215.5844 23156.6770 0.0000 0.0000 44802.1582 -222425.5082 162.9779 -267227.6664 -222050.5459 162.9779 -3089.8517 -2246.7917 921491.4634 -3089.8517 -2246.7917
TIMING: 480 CPU: 225.246, 0.457142/step Wall: 225.246, 0.457142/step, 0.00253968 hours remaining, 3224.289062 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 480 21624.0326 19623.1965 5725.3111 190.1901 -337854.6789 23181.5117 0.0000 0.0000 45051.6820 -222458.7550 163.8856 -267510.4370 -222064.6209 163.8856 -4077.7326 -2291.4891 921491.4634 -4077.7326 -2291.4891
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ENERGY: 482 22186.3465 19466.6794 5728.4964 190.3598 -338044.5417 23192.7474 0.0000 0.0000 44865.8523 -222414.0600 163.2096 -267279.9123 -222051.4112 163.2096 -4059.3094 -2278.0614 921491.4634 -4059.3094 -2278.0614
ENERGY: 483 21553.1412 19511.5744 5729.5660 189.3227 -337426.2183 23165.8740 0.0000 0.0000 44861.8971 -222414.8429 163.1953 -267276.7400 -222048.7671 163.1953 -2964.1718 -2216.4114 921491.4634 -2964.1718 -2216.4114
ENERGY: 484 20460.8924 19631.1938 5730.2465 187.5455 -336590.8884 23126.1351 0.0000 0.0000 45003.6033 -222451.2718 163.7107 -267454.8751 -222059.8743 163.7107 -1565.2422 -2143.1849 921491.4634 -1565.2422 -2143.1849
ENERGY: 485 19688.7718 19800.2990 5730.5256 185.2458 -335902.5866 23092.8470 0.0000 0.0000 44955.5727 -222449.3247 163.5360 -267404.8973 -222045.9607 163.5360 -422.1568 -2086.8735 921491.4634 -422.1568 -2086.8735
ENERGY: 486 19602.5426 19954.8175 5729.7198 182.4662 -335612.3569 23080.3807 0.0000 0.0000 44645.9118 -222416.5183 162.4096 -267062.4300 -222044.6761 162.4096 87.3180 -2070.0981 921491.4634 87.3180 -2070.0981
ENERGY: 487 19881.0927 20072.0212 5727.4348 179.4360 -335846.4483 23091.0544 0.0000 0.0000 44503.3493 -222392.0600 161.8910 -266895.4093 -222045.2408 161.8910 -192.2348 -2106.8840 921491.4634 -192.2348 -2106.8840
ENERGY: 488 20125.2102 20156.1360 5723.5441 176.4338 -336552.5454 23118.8617 0.0000 0.0000 44827.0555 -222425.3041 163.0685 -267252.3596 -222057.1939 163.0685 -1145.7537 -2194.6679 921491.4634 -1145.7537 -2194.6679
ENERGY: 489 20526.8873 20236.4608 5718.5749 173.8639 -337540.4656 23156.7311 0.0000 0.0000 45266.1004 -222461.8473 164.6656 -267727.9477 -222045.6086 164.6656 -2511.2406 -2316.7066 921491.4634 -2511.2406 -2316.7066
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 490 21410.7488 20292.9021 5712.8912 171.8438 -338458.1362 23196.4879 0.0000 0.0000 45213.5630 -222459.6994 164.4745 -267673.2624 -222048.2208 164.4745 -3823.4038 -2437.4154 921491.4634 -3823.4038 -2437.4154
ENERGY: 491 22430.4637 20312.1360 5707.3795 170.5404 -338984.5794 23226.0939 0.0000 0.0000 44733.0090 -222404.9569 162.7264 -267137.9659 -222049.4638 162.7264 -4629.6932 -2524.6214 921491.4634 -4629.6932 -2524.6214
ENERGY: 492 22612.9546 20289.6811 5702.9945 170.0208 -338937.5817 23232.7207 0.0000 0.0000 44542.1950 -222387.0151 162.0323 -266929.2102 -222060.3861 162.0323 -4606.8521 -2557.4729 921491.4634 -4606.8521 -2557.4729
ENERGY: 493 21558.2188 20260.7375 5700.7779 170.3200 -338358.0636 23214.0539 0.0000 0.0000 45033.8228 -222420.1326 163.8207 -267453.9555 -222046.5901 163.8207 -3796.3816 -2540.0995 921491.4634 -3796.3816 -2540.0995
ENERGY: 494 20068.3366 20225.0262 5700.9806 171.2193 -337454.3839 23183.0797 0.0000 0.0000 45622.2475 -222483.4940 165.9612 -268105.7415 -222044.0868 165.9612 -2500.8990 -2482.1068 921491.4634 -2500.8990 -2482.1068
ENERGY: 495 19383.2462 20186.8302 5703.5926 172.5416 -336566.9892 23159.4627 0.0000 0.0000 45484.1232 -222477.1926 165.4587 -267961.3158 -222041.5564 165.4587 -1249.6837 -2407.3056 921491.4634 -1249.6837 -2407.3056
ENERGY: 496 19722.4834 20130.6474 5708.0351 174.0933 -335998.7163 23154.2638 0.0000 0.0000 44699.5272 -222409.6662 162.6046 -267109.1934 -222049.0672 162.6046 -478.8999 -2343.4751 921491.4634 -478.8999 -2343.4751
ENERGY: 497 20212.6670 20059.9178 5713.4613 175.7242 -335952.5050 23166.3548 0.0000 0.0000 44261.0288 -222363.3512 161.0095 -266624.3800 -222042.7502 161.0095 -421.0234 -2316.7928 921491.4634 -421.0234 -2316.7928
ENERGY: 498 20182.0167 19957.1217 5718.5597 177.2604 -336366.4941 23189.3588 0.0000 0.0000 44728.2534 -222413.9235 162.7091 -267142.1768 -222044.5221 162.7091 -993.4682 -2331.6472 921491.4634 -993.4682 -2331.6472
ENERGY: 499 20158.0679 19847.7309 5722.4090 178.6361 -337058.4831 23219.2407 0.0000 0.0000 45439.2644 -222493.1341 165.2956 -267932.3985 -222047.2064 165.2956 -2020.8689 -2376.3390 921491.4634 -2020.8689 -2376.3390
Info: Benchmark time: 4 CPUs 0.456378 s/step 5.28215 days/ns 3224.29 MB memory
TIMING: 500 CPU: 234.317, 0.453524/step Wall: 234.317, 0.453524/step, 0 hours remaining, 3224.289062 MB of memory in use.
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 500 20974.8935 19756.6584 5724.4523 179.8271 -337741.4197 23251.1012 0.0000 0.0000 45359.0780 -222495.4092 165.0039 -267854.4872 -222061.0910 165.0039 -3197.5167 -2425.4141 921491.4634 -3197.5167 -2425.4141
WRITING EXTENDED SYSTEM TO OUTPUT FILE AT STEP 500
WRITING COORDINATES TO OUTPUT FILE AT STEP 500
The last position output (seq=-2) takes 0.002 seconds, 3229.781 MB of memory in use
WRITING VELOCITIES TO OUTPUT FILE AT STEP 500
The last velocity output (seq=-2) takes 0.002 seconds, 3229.781 MB of memory in use
====================================================
WallClock: 241.439987 CPUTime: 241.439987 Memory: 3229.781250 MB
[Partition 0][Node 0] End of program
Application 1110708 resources: utime ~949s, stime ~18s, Rss ~127184, inblocks ~66552, outblocks ~71876
Displaying status file:
verified
/scratch/system/bwjenkins/tests/namd/2.10/cle5.2_gnu5.1.0
WALL=241.439987
CPU=241.439987
MEM=3229.781250
total 744
-rwxr-xr-x 1 bwjenkins BW_System 18 Dec 16 22:50 cputime
-rwxr-xr-x 1 bwjenkins BW_System 19 Dec 16 22:50 memory
-rwxr-xr-x 1 bwjenkins BW_System 18 Dec 16 22:50 wallclock
-rwxr-xr-x 1 bwjenkins BW_System 9 Dec 16 22:50 status
-rwxr-xr-x 1 bwjenkins BW_System 189493 Dec 16 22:50 test.log
-rwxr-xr-x 1 bwjenkins BW_System 505293 Dec 16 22:45 build.log
drwxr-xr-x 2 bwjenkins BW_System 4096 Dec 16 22:45 bin
drwxr-xr-x 11 bwjenkins BW_System 4096 Dec 16 22:35 NAMD_2.10_Source
drwxr-xr-x 5 bwjenkins BW_System 4096 Dec 16 22:23 man
drwxr-xr-x 2 bwjenkins BW_System 4096 Dec 16 22:23 include
drwxr-xr-x 4 bwjenkins BW_System 4096 Dec 16 22:23 lib
-rwxr-xr-x 1 bwjenkins BW_System 1987 Dec 16 22:21 build-notes
-rwxr-xr-x 1 bwjenkins BW_System 4016 Dec 16 22:21 rebuild
lrwxrwxrwx 1 bwjenkins BW_System 7 Dec 16 22:21 relink -> rebuild
-rwxr-xr-x 1 bwjenkins BW_System 761 Dec 16 22:21 remodule
-rwxr-xr-x 1 bwjenkins BW_System 2926 Dec 16 22:21 retest
drwxr-xr-x 12 bwjenkins BW_System 4096 Sep 8 2010 tcl8.5.9
[SSH] completed
[SSH] exit-status: 0
[workspace] $ /bin/sh -xe /tmp/jenkins13899361882063775303.sh
+ rm -rf /var/lib/jenkins/jobs/NAMD/workspace/cputime /var/lib/jenkins/jobs/NAMD/workspace/memory /var/lib/jenkins/jobs/NAMD/workspace/namd /var/lib/jenkins/jobs/NAMD/workspace/wallclock
+ scp JYC_REMOTE:/scratch/system/bwjenkins/tests/namd/2.10/cle5.2_gnu5.1.0/cputime /var/lib/jenkins/jobs/NAMD/workspace
+ scp JYC_REMOTE:/scratch/system/bwjenkins/tests/namd/2.10/cle5.2_gnu5.1.0/memory /var/lib/jenkins/jobs/NAMD/workspace
+ scp JYC_REMOTE:/scratch/system/bwjenkins/tests/namd/2.10/cle5.2_gnu5.1.0/wallclock /var/lib/jenkins/jobs/NAMD/workspace
Recording plot data
Saving plot series data from: /var/lib/jenkins/jobs/NAMD/workspace/wallclock
Saving plot series data from: /var/lib/jenkins/jobs/NAMD/workspace/cputime
Saving plot series data from: /var/lib/jenkins/jobs/NAMD/workspace/memory
Finished: SUCCESS
![[Jenkins]](/static/755cd4af/images/svgs/logo.svg){kind=logo}
