Skipping 712 KB..
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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 ============== 54.3463
LDB: Largest compute 200 load 0.428813 is 1.2% of average load 36.783312
LDB: Average compute 0.051523 is 0.1% of average load 36.783312
LDB: Partitioning computes with target load 3.678331
LDB: Increased migratable compute count from 2736 to 2736
LDB: Largest unpartitionable compute is 0.055969
LDB: ============== END OF LOAD BALANCING =============== 54.3485
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 54.3493
Info: Initial time: 4 CPUs 0.474606 s/step 5.49312 days/ns 3221.61 MB memory
TIMING: 100 CPU: 48.4367, 0.473699/step Wall: 48.4367, 0.473699/step, 0.0526333 hours remaining, 3221.605469 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 ============== 63.8015
LDB: ============== END OF LOAD BALANCING =============== 63.8015
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 63.802
TIMING: 120 CPU: 57.8871, 0.472518/step Wall: 57.8871, 0.472518/step, 0.0498769 hours remaining, 3221.785156 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: 140 CPU: 67.3359, 0.472439/step Wall: 67.3359, 0.472439/step, 0.0472439 hours remaining, 3221.972656 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
ENERGY: 150 21015.8992 19956.3834 5767.3089 192.0924 -334899.3753 20845.5771 0.0000 0.0000 44606.5897 -222515.5246 162.2665 -267122.1143 -222153.2668 162.2665 -4472.9373 -2881.9211 921491.4634 -4472.9373 -2881.9211
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TIMING: 160 CPU: 76.7678, 0.471597/step Wall: 76.7678, 0.471597/step, 0.0445397 hours remaining, 3222.113281 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: 168 21619.4180 19999.6888 5775.3367 206.4584 -333382.4925 20963.4338 0.0000 0.0000 42492.3349 -222325.8219 154.5754 -264818.1568 -222149.7710 154.5754 -1735.9904 -2933.5976 921491.4634 -1735.9904 -2933.5976
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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: 177 21863.3195 18664.1736 5738.9484 156.2659 -332371.2412 20981.6518 0.0000 0.0000 42714.2624 -222252.6197 155.3827 -264966.8821 -222125.5138 155.3827 -2870.6846 -2681.8089 921491.4634 -2870.6846 -2681.8089
ENERGY: 178 21917.7899 18733.9559 5737.6245 154.5770 -332975.2975 21015.2132 0.0000 0.0000 43101.1544 -222314.9826 156.7902 -265416.1369 -222126.1323 156.7902 -2936.2255 -2665.7683 921491.4634 -2936.2255 -2665.7683
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TIMING: 180 CPU: 86.1922, 0.471221/step Wall: 86.1922, 0.471221/step, 0.0418863 hours remaining, 3222.253906 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 19266.0405 19234.9570 5686.4352 181.9571 -332240.0937 21043.7459 0.0000 0.0000 44391.5887 -222435.3693 161.4844 -266826.9580 -222129.2889 161.4844 -2596.4733 -2731.4263 921491.4634 -2596.4733 -2731.4263
ENERGY: 187 22073.2967 19471.4302 5678.7398 184.6336 -333156.1126 21076.9264 0.0000 0.0000 42449.0056 -222222.0802 154.4178 -264671.0858 -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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ENERGY: 198 21224.0060 18800.3006 5711.3574 186.3640 -333385.4998 21161.1533 0.0000 0.0000 43911.2862 -222391.0323 159.7372 -266302.3186 -222090.4395 159.7372 -4381.6808 -2646.7679 921491.4634 -4381.6808 -2646.7679
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LDB: ============= START OF LOAD BALANCING ============== 101.532
LDB: Largest compute 200 load 0.423319 is 1.2% of average load 36.604031
LDB: Average compute 0.051269 is 0.1% of average load 36.604031
LDB: TIME 101.534 LOAD: AVG 36.604 MAX 37.7301 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3222.56 MB
LDB: TIME 101.536 LOAD: AVG 36.604 MAX 37.5656 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 TorusLB MEM: 3222.56 MB
LDB: ============== END OF LOAD BALANCING =============== 101.538
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 101.541
Info: Initial time: 4 CPUs 0.471752 s/step 5.46009 days/ns 3223.56 MB memory
TIMING: 200 CPU: 95.6218, 0.471478/step Wall: 95.6218, 0.471478/step, 0.0392898 hours remaining, 3223.562500 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
ENERGY: 210 21385.1733 20194.2568 5705.3139 178.4614 -336615.7770 21385.1096 0.0000 0.0000 45251.4335 -222516.0284 164.6123 -267767.4619 -222108.2019 164.6123 -6091.3663 -2896.2628 921491.4634 -6091.3663 -2896.2628
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TIMING: 220 CPU: 105.058, 0.471816/step Wall: 105.058, 0.471816/step, 0.0366968 hours remaining, 3223.562500 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: 114.485, 0.471347/step Wall: 114.485, 0.471347/step, 0.0340417 hours remaining, 3223.562500 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: 242 22110.7717 20111.8208 5758.5348 169.0441 -335904.8197 21831.0567 0.0000 0.0000 43526.8718 -222396.7198 158.3388 -265923.5916 -222063.5739 158.3388 -4623.1690 -2633.0914 921491.4634 -4623.1690 -2633.0914
ENERGY: 243 19462.3620 19969.6444 5749.3614 168.8705 -335233.7069 21770.4748 0.0000 0.0000 45537.0690 -222575.9248 165.6513 -268112.9938 -222061.6677 165.6513 -3760.4506 -2614.6993 921491.4634 -3760.4506 -2614.6993
ENERGY: 244 18822.2463 19849.3934 5737.4544 169.6534 -334482.6011 21720.5676 0.0000 0.0000 45629.1663 -222554.1196 165.9864 -268183.2860 -222078.7773 165.9864 -2667.7299 -2573.2150 921491.4634 -2667.7299 -2573.2150
ENERGY: 245 20148.2367 19811.7599 5725.7785 171.4559 -334087.5948 21701.2470 0.0000 0.0000 44168.5249 -222360.5919 160.6730 -266529.1168 -222068.6368 160.6730 -1771.6902 -2533.5455 921491.4634 -1771.6902 -2533.5455
ENERGY: 246 20878.5481 19853.7025 5716.8932 174.1558 -334213.1208 21705.0850 0.0000 0.0000 43600.4182 -222284.3180 158.6063 -265884.7362 -222067.4298 158.6063 -1173.7930 -2523.3912 921491.4634 -1173.7930 -2523.3912
ENERGY: 247 19868.5287 19979.6440 5712.7400 177.5412 -334802.1844 21719.8454 0.0000 0.0000 44912.1912 -222431.6939 163.3782 -267343.8850 -222068.1396 163.3782 -983.0000 -2552.5931 921491.4634 -983.0000 -2552.5931
ENERGY: 248 19035.4924 20164.4297 5713.8450 181.3144 -335623.1355 21746.4311 0.0000 0.0000 46185.9362 -222595.6866 168.0117 -268781.6229 -222090.3128 168.0117 -1359.1247 -2608.3066 921491.4634 -1359.1247 -2608.3066
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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: 252 21994.9041 20013.1599 5733.2541 193.8023 -336093.2676 21826.9295 0.0000 0.0000 43905.3719 -222425.8457 159.7157 -266331.2176 -222091.3306 159.7157 -3843.4681 -2758.0338 921491.4634 -3843.4681 -2758.0338
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ENERGY: 255 20324.2310 19109.4101 5707.6062 196.0620 -333099.9232 21746.1515 0.0000 0.0000 43667.4211 -222349.0411 158.8501 -266016.4622 -222078.3976 158.8501 -2282.5425 -2662.7814 921491.4634 -2282.5425 -2662.7814
ENERGY: 256 20899.4410 18950.9578 5693.4518 195.6570 -332975.5971 21757.6848 0.0000 0.0000 43181.1610 -222297.2438 157.0812 -265478.4049 -222071.2740 157.0812 -2042.2409 -2664.5199 921491.4634 -2042.2409 -2664.5199
ENERGY: 257 20029.5653 18878.1873 5681.1759 194.7976 -333481.0038 21780.2419 0.0000 0.0000 44488.5466 -222428.4891 161.8371 -266917.0357 -222060.1684 161.8371 -2035.5362 -2692.1442 921491.4634 -2035.5362 -2692.1442
ENERGY: 258 19453.5866 18882.0666 5673.2911 193.6684 -334373.1543 21817.5078 0.0000 0.0000 45796.2577 -222556.7762 166.5942 -268353.0339 -222062.0608 166.5942 -2331.2328 -2737.1919 921491.4634 -2331.2328 -2737.1919
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TIMING: 260 CPU: 123.902, 0.470844/step Wall: 123.902, 0.470844/step, 0.0313896 hours remaining, 3223.562500 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: 262 21606.2724 19814.6776 5694.0656 188.7122 -336291.7859 21947.6074 0.0000 0.0000 44601.6345 -222438.8161 162.2485 -267040.4506 -222052.4324 162.2485 -3214.7560 -2810.4637 921491.4634 -3214.7560 -2810.4637
ENERGY: 263 19781.1227 20140.5621 5703.8103 187.9445 -335614.9713 21924.4740 0.0000 0.0000 45349.7771 -222527.2805 164.9700 -267877.0576 -222051.1549 164.9700 -2647.8114 -2773.3903 921491.4634 -2647.8114 -2773.3903
ENERGY: 264 19385.2258 20436.4305 5710.6950 187.5052 -334855.9512 21907.7773 0.0000 0.0000 44751.4784 -222476.8390 162.7936 -267228.3174 -222069.1984 162.7936 -2191.1926 -2723.5293 921491.4634 -2191.1926 -2723.5293
ENERGY: 265 19946.8414 20681.9925 5713.6241 187.4392 -334395.6633 21906.0164 0.0000 0.0000 43607.6374 -222352.1122 158.6326 -265959.7496 -222054.3373 158.6326 -2038.0573 -2683.6034 921491.4634 -2038.0573 -2683.6034
ENERGY: 266 20048.7899 20788.8701 5712.1327 187.6137 -334399.4579 21914.4805 0.0000 0.0000 43399.3796 -222348.1913 157.8750 -265747.5709 -222054.3636 157.8750 -2130.7241 -2664.5956 921491.4634 -2130.7241 -2664.5956
ENERGY: 267 19648.0906 20691.2679 5707.0583 187.8501 -334831.4857 21930.8374 0.0000 0.0000 44220.2168 -222446.1647 160.8610 -266666.3814 -222055.6586 160.8610 -2435.4235 -2662.6783 921491.4634 -2435.4235 -2662.6783
ENERGY: 268 19962.9160 20375.7516 5700.1930 187.9286 -335513.7451 21959.1258 0.0000 0.0000 44823.5377 -222504.2925 163.0557 -267327.8302 -222075.9875 163.0557 -2903.2125 -2658.6181 921491.4634 -2903.2125 -2658.6181
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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: 270 22620.1932 19450.9168 5690.3173 187.1618 -336650.6776 22028.8071 0.0000 0.0000 44308.0075 -222365.2738 161.1804 -266673.2814 -222067.0435 161.1804 -3583.3633 -2617.7583 921491.4634 -3583.3633 -2617.7583
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ENERGY: 272 21021.5584 18896.0662 5692.8269 184.9335 -335921.4616 22015.0580 0.0000 0.0000 45607.7075 -222503.3111 165.9083 -268111.0186 -222081.1573 165.9083 -2551.9683 -2501.8804 921491.4634 -2551.9683 -2501.8804
ENERGY: 273 20123.2135 18932.9080 5697.5118 183.8526 -334925.7013 21985.5296 0.0000 0.0000 45502.7160 -222499.9697 165.5264 -268002.6857 -222069.0460 165.5264 -1837.1974 -2434.6759 921491.4634 -1837.1974 -2434.6759
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ENERGY: 276 19401.8502 19594.7507 5701.2547 182.4904 -333292.1279 21971.0410 0.0000 0.0000 44028.5270 -222412.2140 160.1637 -266440.7409 -222072.9394 160.1637 -1580.1300 -2417.6040 921491.4634 -1580.1300 -2417.6040
ENERGY: 277 19149.2972 19724.7159 5695.5210 182.9396 -333864.3451 21997.2387 0.0000 0.0000 44632.8110 -222481.8217 162.3619 -267114.6327 -222061.0987 162.3619 -2311.7545 -2498.0545 921491.4634 -2311.7545 -2498.0545
ENERGY: 278 20199.4576 19713.7758 5686.9122 183.6585 -334821.1001 22041.3359 0.0000 0.0000 44532.2540 -222463.7061 161.9961 -266995.9601 -222063.4130 161.9961 -3254.8157 -2593.7696 921491.4634 -3254.8157 -2593.7696
ENERGY: 279 21984.3648 19593.9429 5677.5176 184.5187 -335888.5798 22096.4199 0.0000 0.0000 43975.0880 -222376.7279 159.9693 -266351.8159 -222065.2023 159.9693 -4044.3213 -2682.8389 921491.4634 -4044.3213 -2682.8389
TIMING: 280 CPU: 133.305, 0.470156/step Wall: 133.305, 0.470156/step, 0.0287317 hours remaining, 3223.562500 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 19458.4365 5670.0026 185.3899 -336752.6631 22145.1354 0.0000 0.0000 44066.7338 -222367.6418 160.3027 -266434.3757 -222073.4247 160.3027 -4286.3894 -2748.0546 921491.4634 -4286.3894 -2748.0546
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ENERGY: 285 20203.3287 20789.9630 5707.3565 186.7145 -334827.1967 22167.0166 0.0000 0.0000 43418.2629 -222354.5546 157.9437 -265772.8175 -222053.5968 157.9437 -1010.8437 -2700.0820 921491.4634 -1010.8437 -2700.0820
ENERGY: 286 19396.6310 20966.5623 5721.5032 185.8230 -334658.1150 22176.6863 0.0000 0.0000 43785.6880 -222425.2213 159.2803 -266210.9093 -222054.0583 159.2803 -1306.7502 -2717.2847 921491.4634 -1306.7502 -2717.2847
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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 ============== 148.64
LDB: Largest compute 200 load 0.523677 is 1.1% of average load 45.722095
LDB: Average compute 0.064053 is 0.1% of average load 45.722095
LDB: TIME 148.642 LOAD: AVG 45.7221 MAX 47.0989 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3223.98 MB
LDB: TIME 148.643 LOAD: AVG 45.7221 MAX 47.0989 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 RefineTorusLB MEM: 3223.98 MB
LDB: TIME 148.659 LOAD: AVG 45.7221 MAX 46.2249 PROXIES: TOTAL 114 MAXPE 30 MAXPATCH 2 RefineTorusLB MEM: 3223.98 MB
LDB: ============== END OF LOAD BALANCING =============== 148.66
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 148.662
Info: Initial time: 4 CPUs 0.470646 s/step 5.44729 days/ns 3223.98 MB memory
TIMING: 300 CPU: 142.708, 0.470158/step Wall: 142.708, 0.470158/step, 0.0261199 hours remaining, 3223.980469 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: 151.896, 0.459389/step Wall: 151.896, 0.459389/step, 0.0229694 hours remaining, 3223.980469 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: 161.073, 0.458864/step Wall: 161.073, 0.458864/step, 0.0203939 hours remaining, 3223.980469 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: 170.247, 0.458694/step Wall: 170.247, 0.458694/step, 0.0178381 hours remaining, 3223.980469 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: 365 18830.5840 19548.3419 5710.7558 180.6857 -335316.0971 22775.7830 0.0000 0.0000 45760.0887 -222509.8581 166.4626 -268269.9467 -222057.4406 166.4626 -1100.2607 -2433.4823 921491.4634 -1100.2607 -2433.4823
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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: 370 21302.3707 19815.7283 5738.6028 179.1429 -337296.0556 22846.3050 0.0000 0.0000 44920.4941 -222493.4119 163.4084 -267413.9060 -222062.2628 163.4084 -4081.4435 -2576.8189 921491.4634 -4081.4435 -2576.8189
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ENERGY: 377 20646.4607 20251.1594 5706.5521 182.3248 -335763.5801 22794.3773 0.0000 0.0000 43848.2754 -222334.4303 159.5080 -266182.7057 -222041.4014 159.5080 -1819.5857 -2472.4986 921491.4634 -1819.5857 -2472.4986
ENERGY: 378 20473.8099 20495.6596 5711.4639 183.2952 -336584.2279 22821.5836 0.0000 0.0000 44474.7535 -222423.6622 161.7869 -266898.4157 -222044.3968 161.7869 -2972.9873 -2523.3499 921491.4634 -2972.9873 -2523.3499
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TIMING: 380 CPU: 179.416, 0.458447/step Wall: 179.416, 0.458447/step, 0.0152816 hours remaining, 3223.980469 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 19625.4113 19596.0353 5710.5349 179.0647 -336052.0488 22884.2535 0.0000 0.0000 45539.1833 -222517.5659 165.6590 -268056.7492 -222062.0927 165.6590 -569.2379 -2166.9357 921491.4634 -569.2379 -2166.9357
ENERGY: 385 19327.8180 19356.8911 5707.7751 177.4354 -335210.6403 22871.6144 0.0000 0.0000 45299.7171 -222469.3890 164.7879 -267769.1062 -222051.0994 164.7879 215.3515 -2064.3636 921491.4634 215.3515 -2064.3636
ENERGY: 386 19981.2272 19220.9464 5707.6637 175.9384 -334865.1820 22880.7958 0.0000 0.0000 44519.8586 -222378.7516 161.9510 -266898.6103 -222051.0438 161.9510 122.6670 -2011.2428 921491.4634 122.6670 -2011.2428
ENERGY: 387 20367.2860 19202.4845 5710.9354 174.6759 -335109.8728 22905.2745 0.0000 0.0000 44377.1816 -222372.0350 161.4320 -266749.2166 -222053.0051 161.4320 -738.9585 -2019.1689 921491.4634 -738.9585 -2019.1689
ENERGY: 388 20282.3987 19280.0168 5717.2934 173.7038 -335824.1524 22938.2901 0.0000 0.0000 44972.7760 -222459.6734 163.5986 -267432.4494 -222067.4820 163.5986 -2063.8555 -2076.2822 921491.4634 -2063.8555 -2076.2822
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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: 397 19906.7784 20200.7712 5721.4919 176.2273 -336102.8183 22990.0377 0.0000 0.0000 44712.8675 -222394.6443 162.6531 -267107.5118 -222042.6601 162.6531 -376.0864 -2327.2102 921491.4634 -376.0864 -2327.2102
ENERGY: 398 19692.8116 20133.3593 5716.9814 176.0456 -336812.3386 23014.0588 0.0000 0.0000 45592.7321 -222486.3498 165.8538 -268079.0819 -222045.7224 165.8538 -1710.2238 -2443.6966 921491.4634 -1710.2238 -2443.6966
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LDB: ============= START OF LOAD BALANCING ============== 194.548
LDB: Largest compute 230 load 0.524698 is 1.1% of average load 45.662178
LDB: Average compute 0.063947 is 0.1% of average load 45.662178
LDB: TIME 194.55 LOAD: AVG 45.6622 MAX 45.8866 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3223.98 MB
LDB: TIME 194.55 LOAD: AVG 45.6622 MAX 45.8866 PROXIES: TOTAL 114 MAXPE 30 MAXPATCH 2 RefineTorusLB MEM: 3223.98 MB
LDB: TIME 194.551 LOAD: AVG 45.6622 MAX 45.8866 PROXIES: TOTAL 114 MAXPE 30 MAXPATCH 2 RefineTorusLB MEM: 3223.98 MB
LDB: ============== END OF LOAD BALANCING =============== 194.551
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 194.552
Info: Benchmark time: 4 CPUs 0.458802 s/step 5.31021 days/ns 3223.98 MB memory
TIMING: 400 CPU: 188.592, 0.458821/step Wall: 188.592, 0.458821/step, 0.012745 hours remaining, 3223.980469 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 22444.0479 19835.9107 5715.8942 173.8391 -338107.6291 23109.6382 0.0000 0.0000 44436.8099 -222391.4892 161.6489 -266828.2991 -222049.2228 161.6489 -4939.3794 -2681.7024 921491.4634 -4939.3794 -2681.7024
ENERGY: 403 20784.9694 19778.4826 5715.7218 174.2695 -337239.9788 23077.8406 0.0000 0.0000 45225.5963 -222483.0986 164.5183 -267708.6950 -222046.6856 164.5183 -3613.5977 -2605.7428 921491.4634 -3613.5977 -2605.7428
ENERGY: 404 19687.5953 19735.4027 5713.8114 175.5084 -336169.1145 23038.2904 0.0000 0.0000 45313.8393 -222504.6671 164.8393 -267818.5064 -222060.2373 164.8393 -1967.0747 -2494.0439 921491.4634 -1967.0747 -2494.0439
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ENERGY: 408 19735.8471 19387.6644 5692.2151 187.5226 -335902.8225 23017.8178 0.0000 0.0000 45394.4121 -222487.3434 165.1324 -267881.7555 -222063.5313 165.1324 -920.8281 -2294.1555 921491.4634 -920.8281 -2294.1555
ENERGY: 409 20350.1188 19376.4607 5688.4775 191.1592 -336896.6853 23057.9927 0.0000 0.0000 45733.6059 -222498.8705 166.3663 -268232.4764 -222051.6706 166.3663 -2367.4919 -2346.9324 921491.4634 -2367.4919 -2346.9324
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 410 21850.5210 19470.1802 5687.6649 194.4179 -337813.1852 23106.2034 0.0000 0.0000 45077.0716 -222427.1262 163.9780 -267504.1978 -222054.6429 163.9780 -3838.6210 -2402.0239 921491.4634 -3838.6210 -2402.0239
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ENERGY: 413 21130.1416 20138.5248 5699.9334 199.7191 -337872.5325 23125.1121 0.0000 0.0000 45113.2145 -222465.8869 164.1095 -267579.1014 -222055.3453 164.1095 -3850.6267 -2398.9547 921491.4634 -3850.6267 -2398.9547
ENERGY: 414 19987.3857 20381.5507 5705.1135 199.5118 -337122.7804 23094.4563 0.0000 0.0000 45271.6529 -222483.1097 164.6858 -267754.7626 -222052.1623 164.6858 -2501.3240 -2333.9462 921491.4634 -2501.3240 -2333.9462
ENERGY: 415 19745.2666 20572.1260 5708.7452 198.1487 -336456.1980 23071.1996 0.0000 0.0000 44733.2274 -222427.4844 162.7272 -267160.7119 -222049.0346 162.7272 -1174.6451 -2266.5614 921491.4634 -1174.6451 -2266.5614
ENERGY: 416 19942.3169 20661.9897 5710.0857 195.6953 -336157.5871 23063.1720 0.0000 0.0000 44200.2851 -222384.0423 160.7885 -266584.3274 -222052.9646 160.7885 -282.7613 -2224.6896 921491.4634 -282.7613 -2224.6896
ENERGY: 417 20031.3750 20631.3210 5709.0493 192.4696 -336373.1085 23072.1103 0.0000 0.0000 44338.4620 -222398.3212 161.2911 -266736.7832 -222044.6995 161.2911 -112.4553 -2227.1698 921491.4634 -112.4553 -2227.1698
ENERGY: 418 20154.6649 20457.0910 5705.5847 188.6536 -336970.7877 23098.6731 0.0000 0.0000 44915.1424 -222450.9781 163.3889 -267366.1204 -222046.7095 163.3889 -671.8546 -2269.9920 921491.4634 -671.8546 -2269.9920
ENERGY: 419 20790.7632 20185.5523 5700.4810 184.6054 -337717.8766 23139.8028 0.0000 0.0000 45250.3103 -222466.3615 164.6082 -267716.6718 -222049.5952 164.6082 -1783.9421 -2336.6463 921491.4634 -1783.9421 -2336.6463
TIMING: 420 CPU: 197.729, 0.456841/step Wall: 197.729, 0.456841/step, 0.010152 hours remaining, 3223.980469 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: 423 21418.8985 19324.4272 5689.6736 172.2145 -337416.8964 23180.6045 0.0000 0.0000 45183.9714 -222447.1067 164.3669 -267631.0781 -222051.5236 164.3669 -3955.8305 -2434.9305 921491.4634 -3955.8305 -2434.9305
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ENERGY: 427 19598.5317 19595.2899 5707.1504 168.7509 -335498.4327 23074.5012 0.0000 0.0000 44915.2774 -222438.9312 163.3894 -267354.2086 -222048.7339 163.3894 -741.9009 -2207.6354 921491.4634 -741.9009 -2207.6354
ENERGY: 428 20140.4229 19760.4170 5710.4628 168.5259 -336199.9863 23087.7682 0.0000 0.0000 44884.2593 -222448.1302 163.2766 -267332.3895 -222058.0554 163.2766 -935.5733 -2206.9585 921491.4634 -935.5733 -2206.9585
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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 21768.3702 20188.6724 5710.3546 168.1086 -338651.2098 23176.0849 0.0000 0.0000 45177.9907 -222461.6285 164.3451 -267639.6192 -222065.9059 164.3451 -3350.2739 -2296.1495 921491.4634 -3350.2739 -2296.1495
ENERGY: 433 21200.9070 20275.9664 5710.3763 168.4633 -338164.0633 23162.2913 0.0000 0.0000 45192.9280 -222453.1311 164.3995 -267646.0591 -222052.5982 164.3995 -3187.3730 -2272.1274 921491.4634 -3187.3730 -2272.1274
ENERGY: 434 20730.3411 20338.1500 5711.6061 169.3247 -337394.2700 23140.7737 0.0000 0.0000 44883.0993 -222420.9752 163.2724 -267304.0744 -222051.1462 163.2724 -2694.3106 -2227.7883 921491.4634 -2694.3106 -2227.7883
ENERGY: 435 20235.2200 20362.4016 5714.0003 170.8455 -336680.6551 23123.4099 0.0000 0.0000 44675.9834 -222398.7944 162.5189 -267074.7778 -222049.5889 162.5189 -2061.3581 -2179.8950 921491.4634 -2061.3581 -2179.8950
ENERGY: 436 19670.9242 20349.9983 5717.2345 173.0864 -336303.8809 23119.9079 0.0000 0.0000 44847.0979 -222425.6318 163.1414 -267272.7297 -222059.6960 163.1414 -1520.6598 -2145.1616 921491.4634 -1520.6598 -2145.1616
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ENERGY: 438 19935.1532 20278.6096 5724.6883 179.3848 -336899.4575 23173.5519 0.0000 0.0000 45148.1322 -222459.9375 164.2365 -267608.0697 -222051.5669 164.2365 -1493.0942 -2145.0881 921491.4634 -1493.0942 -2145.0881
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TIMING: 440 CPU: 206.875, 0.457276/step Wall: 206.875, 0.457276/step, 0.00762127 hours remaining, 3223.980469 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 22071.5683 20036.2371 5729.7527 186.7201 -338123.1807 23276.2484 0.0000 0.0000 44417.5459 -222405.1081 161.5788 -266822.6540 -222059.4775 161.5788 -2408.4613 -2197.9671 921491.4634 -2408.4613 -2197.9671
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ENERGY: 442 21853.6116 19664.5349 5729.4854 192.9411 -338090.1532 23327.1565 0.0000 0.0000 44880.6321 -222441.7916 163.2634 -267322.4237 -222049.7758 163.2634 -2710.5576 -2229.0696 921491.4634 -2710.5576 -2229.0696
ENERGY: 443 21064.3314 19487.0722 5727.6164 194.9329 -337369.3149 23320.0155 0.0000 0.0000 45118.1108 -222457.2357 164.1273 -267575.3465 -222048.5998 164.1273 -2448.1648 -2220.3531 921491.4634 -2448.1648 -2220.3531
ENERGY: 444 20449.3362 19357.2690 5725.4095 195.8735 -336464.1923 23301.5273 0.0000 0.0000 44987.7178 -222447.0592 163.6530 -267434.7769 -222057.9801 163.6530 -2090.2100 -2206.4400 921491.4634 -2090.2100 -2206.4400
ENERGY: 445 20125.5608 19307.2517 5723.6513 195.6942 -335759.3916 23283.8136 0.0000 0.0000 44708.7155 -222414.7045 162.6380 -267123.4200 -222046.5432 162.6380 -1846.9628 -2201.6927 921491.4634 -1846.9628 -2201.6927
ENERGY: 446 19947.6806 19324.9005 5722.5430 194.3235 -335494.5710 23276.0448 0.0000 0.0000 44620.2944 -222408.7842 162.3164 -267029.0787 -222046.1624 162.3164 -1800.7520 -2216.7295 921491.4634 -1800.7520 -2216.7295
ENERGY: 447 19914.2849 19416.0209 5722.2107 191.8642 -335769.4402 23282.7455 0.0000 0.0000 44816.5087 -222425.8053 163.0301 -267242.3140 -222046.8346 163.0301 -1993.3115 -2253.0604 921491.4634 -1993.3115 -2253.0604
ENERGY: 448 20187.5921 19583.6799 5722.5764 188.5554 -336503.1802 23303.8900 0.0000 0.0000 45065.6674 -222451.2189 163.9365 -267516.8863 -222059.3485 163.9365 -2372.1882 -2303.7901 921491.4634 -2372.1882 -2303.7901
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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 21754.4853 20108.1299 5724.4776 181.0898 -338419.3248 23364.6239 0.0000 0.0000 44854.3093 -222432.2090 163.1676 -267286.5183 -222048.7865 163.1676 -3116.6759 -2394.3899 921491.4634 -3116.6759 -2394.3899
ENERGY: 451 22355.5901 20357.7255 5724.7144 177.6517 -338952.0905 23381.8003 0.0000 0.0000 44542.6981 -222411.9104 162.0341 -266954.6085 -222048.8250 162.0341 -3074.2535 -2405.7800 921491.4634 -3074.2535 -2405.7800
ENERGY: 452 22246.2013 20536.0134 5723.8953 174.8859 -338927.1535 23378.0940 0.0000 0.0000 44452.9190 -222415.1445 161.7075 -266868.0635 -222059.6376 161.7075 -2659.9606 -2384.7569 921491.4634 -2659.9606 -2384.7569
ENERGY: 453 21399.8724 20641.1311 5722.2879 173.1350 -338392.7932 23354.5905 0.0000 0.0000 44683.7027 -222418.0736 162.5470 -267101.7763 -222043.5377 162.5470 -2048.3339 -2342.4670 921491.4634 -2048.3339 -2342.4670
ENERGY: 454 20248.3380 20654.1374 5720.2217 172.3637 -337567.1413 23320.6899 0.0000 0.0000 45008.1459 -222443.2448 163.7273 -267451.3906 -222041.8397 163.7273 -1453.4580 -2293.1452 921491.4634 -1453.4580 -2293.1452
ENERGY: 455 19486.7906 20584.7120 5718.4844 172.5169 -336790.6453 23290.4022 0.0000 0.0000 45086.5783 -222451.1609 164.0126 -267537.7392 -222040.8576 164.0126 -1151.8826 -2255.8573 921491.4634 -1151.8826 -2255.8573
ENERGY: 456 19493.3722 20440.6799 5717.7556 173.4249 -336350.1076 23274.9630 0.0000 0.0000 44811.4721 -222438.4400 163.0118 -267249.9121 -222055.3491 163.0118 -1305.5007 -2245.5825 921491.4634 -1305.5007 -2245.5825
ENERGY: 457 20047.4929 20251.9433 5718.5580 174.9241 -336395.8166 23277.8274 0.0000 0.0000 44521.8701 -222403.2007 161.9583 -266925.0709 -222049.4138 161.9583 -1906.4168 -2263.5015 921491.4634 -1906.4168 -2263.5015
ENERGY: 458 20585.8435 20019.2720 5720.7061 176.6081 -336835.0961 23294.7173 0.0000 0.0000 44632.7887 -222405.1604 162.3618 -267037.9491 -222051.2827 162.3618 -2684.6990 -2301.0429 921491.4634 -2684.6990 -2301.0429
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TIMING: 460 CPU: 216.024, 0.457479/step Wall: 216.024, 0.457479/step, 0.0050831 hours remaining, 3223.980469 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 19487.8109 5736.4823 180.9531 -337988.7169 23351.1087 0.0000 0.0000 44559.9288 -222408.2076 162.0968 -266968.1364 -222056.7216 162.0968 -2954.8200 -2323.4251 921491.4634 -2954.8200 -2323.4251
ENERGY: 463 21821.1790 19513.9017 5738.9361 181.1160 -337284.1028 23326.9479 0.0000 0.0000 44313.4567 -222388.5654 161.2002 -266702.0221 -222054.6244 161.2002 -2012.4424 -2264.0778 921491.4634 -2012.4424 -2264.0778
ENERGY: 464 20535.2460 19559.9274 5739.2518 181.0096 -336389.3844 23291.1944 0.0000 0.0000 44654.0263 -222428.7289 162.4391 -267082.7552 -222058.5733 162.4391 -1050.9227 -2205.5269 921491.4634 -1050.9227 -2205.5269
ENERGY: 465 19322.7827 19631.8856 5737.2899 180.7155 -335701.1539 23259.7394 0.0000 0.0000 45094.5684 -222474.1724 164.0416 -267568.7408 -222052.9392 164.0416 -512.3347 -2174.4008 921491.4634 -512.3347 -2174.4008
ENERGY: 466 19088.4512 19708.3583 5733.2107 180.2808 -335443.7731 23245.0607 0.0000 0.0000 45020.7904 -222467.6210 163.7733 -267488.4114 -222052.9789 163.7733 -630.3314 -2182.6710 921491.4634 -630.3314 -2182.6710
ENERGY: 467 19841.8071 19783.1744 5727.6704 179.7757 -335721.0956 23249.4533 0.0000 0.0000 44523.6661 -222415.5487 161.9649 -266939.2147 -222054.3499 161.9649 -1393.6030 -2232.5924 921491.4634 -1393.6030 -2232.5924
ENERGY: 468 20761.8482 19845.4944 5721.5089 179.2779 -336451.5669 23265.8130 0.0000 0.0000 44291.6580 -222385.9665 161.1209 -266677.6245 -222056.3593 161.1209 -2508.6713 -2314.1339 921491.4634 -2508.6713 -2314.1339
ENERGY: 469 21236.3016 19910.2022 5715.6824 178.8504 -337458.3203 23284.3966 0.0000 0.0000 44720.3196 -222412.5675 162.6802 -267132.8871 -222046.0752 162.6802 -3596.7405 -2405.7971 921491.4634 -3596.7405 -2405.7971
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 470 21411.1730 19972.8935 5710.9491 178.5947 -338383.2507 23297.0678 0.0000 0.0000 45346.4567 -222466.1159 164.9579 -267812.5726 -222047.6091 164.9579 -4259.6994 -2477.6829 921491.4634 -4259.6994 -2477.6829
ENERGY: 471 21732.8676 20054.6835 5707.9626 178.5890 -338913.2450 23297.5091 0.0000 0.0000 45471.3359 -222470.2973 165.4122 -267941.6332 -222047.5361 165.4122 -4290.5681 -2504.3173 921491.4634 -4290.5681 -2504.3173
ENERGY: 472 22081.2359 20161.5550 5707.0091 178.9047 -338870.6765 23279.4498 0.0000 0.0000 45028.5288 -222433.9932 163.8014 -267462.5221 -222059.5061 163.8014 -3659.7359 -2479.9182 921491.4634 -3659.7359 -2479.9182
ENERGY: 473 21866.1360 20289.3424 5707.9843 179.6165 -338307.7189 23240.7370 0.0000 0.0000 44634.5165 -222389.3862 162.3681 -267023.9027 -222043.8543 162.3681 -2556.3614 -2408.1656 921491.4634 -2556.3614 -2408.1656
ENERGY: 474 20842.9703 20372.0983 5710.2160 180.7466 -337438.4551 23189.2355 0.0000 0.0000 44733.2298 -222409.9585 162.7272 -267143.1883 -222041.2623 162.7272 -1295.5523 -2316.2727 921491.4634 -1295.5523 -2316.2727
ENERGY: 475 19674.2080 20371.7670 5712.9876 182.2512 -336604.2312 23142.3825 0.0000 0.0000 45070.2130 -222450.4219 163.9530 -267520.6349 -222039.4533 163.9530 -344.6448 -2232.2125 921491.4634 -344.6448 -2232.2125
ENERGY: 476 19235.7863 20282.0270 5715.7683 184.0125 -336100.0903 23115.8474 0.0000 0.0000 45106.0625 -222460.5863 164.0835 -267566.6488 -222053.6140 164.0835 -92.4049 -2183.0651 921491.4634 -92.4049 -2183.0651
ENERGY: 477 19704.7250 20145.9809 5718.4976 185.9230 -336101.8790 23114.2947 0.0000 0.0000 44812.3200 -222420.1376 163.0149 -267232.4577 -222044.8413 163.0149 -667.4945 -2171.8227 921491.4634 -667.4945 -2171.8227
ENERGY: 478 20493.4776 19974.7635 5721.0254 187.7262 -336537.4037 23131.2468 0.0000 0.0000 44627.0326 -222402.1317 162.3409 -267029.1642 -222047.4109 162.3409 -1807.1603 -2198.7955 921491.4634 -1807.1603 -2198.7955
ENERGY: 479 21125.3057 19793.3953 5723.3295 189.2099 -337215.5839 23156.6779 0.0000 0.0000 44802.1571 -222425.5085 162.9779 -267227.6656 -222050.5462 162.9779 -3089.8515 -2246.7916 921491.4634 -3089.8515 -2246.7916
TIMING: 480 CPU: 225.168, 0.457198/step Wall: 225.168, 0.457198/step, 0.00253999 hours remaining, 3223.980469 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 19623.1963 5725.3111 190.1900 -337854.6784 23181.5125 0.0000 0.0000 45051.6808 -222458.7551 163.8856 -267510.4358 -222064.6210 163.8856 -4077.7323 -2291.4889 921491.4634 -4077.7323 -2291.4889
ENERGY: 481 22092.4852 19510.0433 5727.0952 190.6351 -338199.2479 23196.7965 0.0000 0.0000 45041.3362 -222440.8564 163.8480 -267482.1925 -222052.5266 163.8480 -4466.2391 -2305.6730 921491.4634 -4466.2391 -2305.6730
ENERGY: 482 22186.3466 19466.6795 5728.4964 190.3598 -338044.5418 23192.7480 0.0000 0.0000 44865.8514 -222414.0601 163.2096 -267279.9115 -222051.4113 163.2096 -4059.3095 -2278.0613 921491.4634 -4059.3095 -2278.0613
ENERGY: 483 21553.1412 19511.5746 5729.5660 189.3227 -337426.2186 23165.8746 0.0000 0.0000 44861.8964 -222414.8430 163.1952 -267276.7395 -222048.7673 163.1952 -2964.1720 -2216.4114 921491.4634 -2964.1720 -2216.4114
ENERGY: 484 20460.8926 19631.1941 5730.2465 187.5455 -336590.8888 23126.1357 0.0000 0.0000 45003.6027 -222451.2718 163.7107 -267454.8745 -222059.8743 163.7107 -1565.2423 -2143.1848 921491.4634 -1565.2423 -2143.1848
ENERGY: 485 19688.7722 19800.2993 5730.5256 185.2458 -335902.5871 23092.8476 0.0000 0.0000 44955.5720 -222449.3247 163.5360 -267404.8967 -222045.9607 163.5360 -422.1569 -2086.8734 921491.4634 -422.1569 -2086.8734
ENERGY: 486 19602.5428 19954.8178 5729.7198 182.4662 -335612.3573 23080.3813 0.0000 0.0000 44645.9112 -222416.5182 162.4096 -267062.4294 -222044.6761 162.4096 87.3181 -2070.0981 921491.4634 87.3181 -2070.0981
ENERGY: 487 19881.0926 20072.0214 5727.4348 179.4360 -335846.4487 23091.0549 0.0000 0.0000 44503.3490 -222392.0600 161.8910 -266895.4090 -222045.2408 161.8910 -192.2346 -2106.8839 921491.4634 -192.2346 -2106.8839
ENERGY: 488 20125.2099 20156.1362 5723.5441 176.4338 -336552.5458 23118.8621 0.0000 0.0000 44827.0553 -222425.3044 163.0685 -267252.3597 -222057.1941 163.0685 -1145.7534 -2194.6679 921491.4634 -1145.7534 -2194.6679
ENERGY: 489 20526.8871 20236.4609 5718.5749 173.8639 -337540.4659 23156.7315 0.0000 0.0000 45266.1000 -222461.8477 164.6656 -267727.9476 -222045.6089 164.6656 -2511.2404 -2316.7066 921491.4634 -2511.2404 -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 21410.7489 20292.9021 5712.8912 171.8438 -338458.1363 23196.4882 0.0000 0.0000 45213.5624 -222459.6997 164.4745 -267673.2621 -222048.2211 164.4745 -3823.4037 -2437.4154 921491.4634 -3823.4037 -2437.4154
ENERGY: 491 22430.4639 20312.1359 5707.3795 170.5404 -338984.5794 23226.0941 0.0000 0.0000 44733.0084 -222404.9572 162.7264 -267137.9656 -222049.4642 162.7264 -4629.6932 -2524.6214 921491.4634 -4629.6932 -2524.6214
ENERGY: 492 22612.9545 20289.6809 5702.9944 170.0208 -338937.5814 23232.7209 0.0000 0.0000 44542.1946 -222387.0153 162.0323 -266929.2099 -222060.3863 162.0323 -4606.8522 -2557.4729 921491.4634 -4606.8522 -2557.4729
ENERGY: 493 21558.2186 20260.7372 5700.7779 170.3201 -338358.0631 23214.0540 0.0000 0.0000 45033.8225 -222420.1328 163.8207 -267453.9553 -222046.5903 163.8207 -3796.3817 -2540.0995 921491.4634 -3796.3817 -2540.0995
ENERGY: 494 20068.3365 20225.0259 5700.9805 171.2193 -337454.3832 23183.0799 0.0000 0.0000 45622.2470 -222483.4942 165.9612 -268105.7412 -222044.0870 165.9612 -2500.8992 -2482.1068 921491.4634 -2500.8992 -2482.1068
ENERGY: 495 19383.2463 20186.8299 5703.5926 172.5416 -336566.9884 23159.4628 0.0000 0.0000 45484.1224 -222477.1928 165.4587 -267961.3152 -222041.5566 165.4587 -1249.6837 -2407.3055 921491.4634 -1249.6837 -2407.3055
ENERGY: 496 19722.4834 20130.6471 5708.0350 174.0933 -335998.7150 23154.2639 0.0000 0.0000 44699.5263 -222409.6660 162.6046 -267109.1923 -222049.0670 162.6046 -478.8997 -2343.4749 921491.4634 -478.8997 -2343.4749
ENERGY: 497 20212.6668 20059.9175 5713.4613 175.7242 -335952.5036 23166.3548 0.0000 0.0000 44261.0279 -222363.3511 161.0095 -266624.3790 -222042.7500 161.0095 -421.0231 -2316.7926 921491.4634 -421.0231 -2316.7926
ENERGY: 498 20182.0164 19957.1214 5718.5596 177.2604 -336366.4925 23189.3588 0.0000 0.0000 44728.2525 -222413.9234 162.7091 -267142.1758 -222044.5220 162.7091 -993.4678 -2331.6470 921491.4634 -993.4678 -2331.6470
ENERGY: 499 20158.0677 19847.7308 5722.4089 178.6361 -337058.4814 23219.2406 0.0000 0.0000 45439.2634 -222493.1339 165.2956 -267932.3973 -222047.2062 165.2956 -2020.8685 -2376.3388 921491.4634 -2020.8685 -2376.3388
Info: Benchmark time: 4 CPUs 0.456445 s/step 5.28293 days/ns 3223.98 MB memory
TIMING: 500 CPU: 234.237, 0.453439/step Wall: 234.237, 0.453439/step, 0 hours remaining, 3223.980469 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 19756.6583 5724.4523 179.8271 -337741.4187 23251.1010 0.0000 0.0000 45359.0766 -222495.4098 165.0039 -267854.4865 -222061.0916 165.0039 -3197.5168 -2425.4143 921491.4634 -3197.5168 -2425.4143
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, 3228.883 MB of memory in use
WRITING VELOCITIES TO OUTPUT FILE AT STEP 500
The last velocity output (seq=-2) takes 0.002 seconds, 3228.883 MB of memory in use
====================================================
WallClock: 241.079605 CPUTime: 241.079605 Memory: 3228.882812 MB
[Partition 0][Node 0] End of program
Application 102612819 resources: utime ~948s, stime ~19s, Rss ~126748, inblocks ~67012, outblocks ~72238
Displaying status file:
verified
[SSH] completed
[SSH] exit-status: 0
[workspace] $ /bin/sh -xe /tmp/jenkins5547123874109546052.sh
+ scp BW_REMOTE_2:/scratch/system/bwjenkins/tests/namd/2.10/cle5.2_gnu5.1.0/cputime /var/lib/jenkins/jobs/NAMD-h2ologin4/workspace
+ scp BW_REMOTE_2:/scratch/system/bwjenkins/tests/namd/2.10/cle5.2_gnu5.1.0/memory /var/lib/jenkins/jobs/NAMD-h2ologin4/workspace
+ scp BW_REMOTE_2:/scratch/system/bwjenkins/tests/namd/2.10/cle5.2_gnu5.1.0/wallclock /var/lib/jenkins/jobs/NAMD-h2ologin4/workspace
Recording plot data
Saving plot series data from: /var/lib/jenkins/jobs/NAMD-h2ologin4/workspace/wallclock
Saving plot series data from: /var/lib/jenkins/jobs/NAMD-h2ologin4/workspace/cputime
Saving plot series data from: /var/lib/jenkins/jobs/NAMD-h2ologin4/workspace/memory
Finished: SUCCESS
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