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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 ============== 54.8241
LDB: Largest compute 200 load 0.432848 is 1.2% of average load 36.905335
LDB: Average compute 0.051702 is 0.1% of average load 36.905335
LDB: Partitioning computes with target load 3.690534
LDB: Increased migratable compute count from 2736 to 2736
LDB: Largest unpartitionable compute is 0.055430
LDB: ============== END OF LOAD BALANCING =============== 54.8262
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 54.8271
Info: Initial time: 4 CPUs 0.475681 s/step 5.50557 days/ns 3221.53 MB memory
TIMING: 100 CPU: 48.538, 0.474683/step Wall: 48.538, 0.474683/step, 0.0527426 hours remaining, 3221.527344 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 ============== 64.3023
LDB: ============== END OF LOAD BALANCING =============== 64.3023
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 64.3028
TIMING: 120 CPU: 58.0133, 0.473767/step Wall: 58.0133, 0.473767/step, 0.0500088 hours remaining, 3221.664062 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 19195.4801 5730.8549 192.8766 -333203.4340 21083.5324 0.0000 0.0000 42784.9639 -222340.8736 155.6399 -265125.8375 -222213.1813 155.6399 -2704.7056 -2927.3525 921491.4634 -2704.7056 -2927.3525
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TIMING: 140 CPU: 67.4803, 0.473348/step Wall: 67.4803, 0.473348/step, 0.0473348 hours remaining, 3221.921875 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: 160 CPU: 76.9392, 0.472946/step Wall: 76.9392, 0.472946/step, 0.0446671 hours remaining, 3222.230469 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 21619.4181 19999.6890 5775.3367 206.4584 -333382.4927 20963.4338 0.0000 0.0000 42492.3352 -222325.8216 154.5754 -264818.1568 -222149.7707 154.5754 -1735.9905 -2933.5977 921491.4634 -1735.9905 -2933.5977
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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 21917.7899 18733.9558 5737.6245 154.5770 -332975.2976 21015.2132 0.0000 0.0000 43101.1546 -222314.9826 156.7902 -265416.1371 -222126.1323 156.7902 -2936.2256 -2665.7682 921491.4634 -2936.2256 -2665.7682
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TIMING: 180 CPU: 86.3876, 0.472422/step Wall: 86.3876, 0.472422/step, 0.0419931 hours remaining, 3222.230469 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: 184 18376.8755 19424.9916 5710.5469 174.1844 -332181.9082 21042.4479 0.0000 0.0000 44880.5528 -222572.3092 163.2631 -267452.8619 -222144.6143 163.2631 -1576.6176 -2645.2274 921491.4634 -1576.6176 -2645.2274
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ENERGY: 186 19266.0405 19234.9571 5686.4352 181.9571 -332240.0938 21043.7459 0.0000 0.0000 44391.5887 -222435.3692 161.4844 -266826.9579 -222129.2889 161.4844 -2596.4731 -2731.4263 921491.4634 -2596.4731 -2731.4263
ENERGY: 187 22073.2967 19471.4304 5678.7398 184.6336 -333156.1128 21076.9264 0.0000 0.0000 42449.0056 -222222.0802 154.4178 -264671.0858 -222130.9081 154.4178 -3641.8535 -2802.0866 921491.4634 -3641.8535 -2802.0866
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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: 197 21700.3670 19122.7579 5714.1451 184.7200 -332668.2730 21129.4588 0.0000 0.0000 42574.3655 -222242.4587 154.8738 -264816.8242 -222086.7180 154.8738 -3040.7437 -2596.5495 921491.4634 -3040.7437 -2596.5495
ENERGY: 198 21224.0060 18800.3005 5711.3574 186.3640 -333385.4997 21161.1533 0.0000 0.0000 43911.2864 -222391.0321 159.7372 -266302.3185 -222090.4392 159.7372 -4381.6809 -2646.7680 921491.4634 -4381.6809 -2646.7680
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LDB: ============= START OF LOAD BALANCING ============== 102.124
LDB: Largest compute 200 load 0.426986 is 1.2% of average load 36.723017
LDB: Average compute 0.051449 is 0.1% of average load 36.723017
LDB: TIME 102.126 LOAD: AVG 36.723 MAX 37.8211 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3222.61 MB
LDB: TIME 102.128 LOAD: AVG 36.723 MAX 37.7264 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 TorusLB MEM: 3222.61 MB
LDB: ============== END OF LOAD BALANCING =============== 102.13
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 102.133
Info: Initial time: 4 CPUs 0.472941 s/step 5.47385 days/ns 3223.47 MB memory
TIMING: 200 CPU: 95.8419, 0.47271/step Wall: 95.8419, 0.47271/step, 0.0393925 hours remaining, 3223.472656 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: 200 21073.6838 18595.6349 5711.8747 190.0258 -334670.2813 21209.9247 0.0000 0.0000 45319.1601 -222569.9773 164.8586 -267889.1374 -222114.5246 164.8586 -5241.8527 -2703.6814 921491.4634 -5241.8527 -2703.6814
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ENERGY: 202 23622.8118 18850.8450 5722.5980 192.1474 -334305.3009 21243.2751 0.0000 0.0000 42432.5588 -222241.0648 154.3580 -264673.6236 -222096.8292 154.3580 -3005.0520 -2588.0014 921491.4634 -3005.0520 -2588.0014
ENERGY: 203 20743.8945 19130.0390 5729.2400 192.0764 -333501.9374 21215.8253 0.0000 0.0000 44059.6987 -222431.1635 160.2771 -266490.8622 -222093.6428 160.2771 -1046.8258 -2512.4436 921491.4634 -1046.8258 -2512.4436
ENERGY: 204 17862.6123 19486.9557 5734.1463 191.2124 -332722.2200 21188.8402 0.0000 0.0000 45629.4720 -222628.9811 165.9875 -268258.4531 -222116.7003 165.9875 452.9932 -2462.2931 921491.4634 452.9932 -2462.2931
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ENERGY: 207 21693.8032 20338.2891 5726.5434 185.3060 -333603.9791 21289.9001 0.0000 0.0000 42143.6913 -222226.4460 153.3072 -264370.1373 -222103.0934 153.3072 -1896.3479 -2585.9684 921491.4634 -1896.3479 -2585.9684
ENERGY: 208 20293.2703 20371.8904 5718.1572 182.8654 -334789.2376 21322.2409 0.0000 0.0000 44428.6269 -222472.1865 161.6191 -266900.8134 -222122.6314 161.6191 -3669.0642 -2719.7951 921491.4634 -3669.0642 -2719.7951
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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 21385.1736 20194.2569 5705.3139 178.4614 -336615.7766 21385.1095 0.0000 0.0000 45251.4333 -222516.0281 164.6123 -267767.4614 -222108.2015 164.6123 -6091.3663 -2896.2626 921491.4634 -6091.3663 -2896.2626
ENERGY: 211 24099.1930 19985.8631 5704.9373 176.9105 -336667.8925 21415.1476 0.0000 0.0000 43031.7284 -222254.1128 156.5376 -265285.8411 -222106.8541 156.5376 -5900.2977 -2885.1009 921491.4634 -5900.2977 -2885.1009
ENERGY: 212 23739.2710 19730.8221 5710.0295 176.0352 -336013.6225 21412.5982 0.0000 0.0000 42995.1638 -222249.7027 156.4046 -265244.8664 -222104.2319 156.4046 -4424.1002 -2820.3210 921491.4634 -4424.1002 -2820.3210
ENERGY: 213 20150.2160 19524.5247 5720.1722 175.9508 -334874.6441 21380.5551 0.0000 0.0000 45418.7806 -222504.4448 165.2210 -267923.2254 -222097.3835 165.2210 -2174.3117 -2725.0841 921491.4634 -2174.3117 -2725.0841
ENERGY: 214 17315.5528 19421.7446 5733.3059 176.6827 -333645.3934 21358.4485 0.0000 0.0000 46958.4704 -222681.1886 170.8220 -269639.6589 -222093.7408 170.8220 -143.6684 -2626.0578 921491.4634 -143.6684 -2626.0578
ENERGY: 215 18210.5055 19441.9742 5746.5772 178.1492 -332787.3320 21379.5595 0.0000 0.0000 45302.6747 -222527.8917 164.7987 -267830.5664 -222091.0448 164.7987 784.0016 -2554.0367 921491.4634 784.0016 -2554.0367
ENERGY: 216 20973.4717 19522.5061 5756.9571 180.1770 -332560.1058 21436.4835 0.0000 0.0000 42442.1788 -222248.3316 154.3930 -264690.5104 -222073.6155 154.3930 420.9902 -2541.5428 921491.4634 420.9902 -2541.5428
ENERGY: 217 21778.3867 19581.4819 5762.2416 182.5517 -333010.6756 21497.2705 0.0000 0.0000 41983.6751 -222225.0681 152.7251 -264208.7432 -222064.4463 152.7251 -882.1698 -2598.7243 921491.4634 -882.1698 -2598.7243
ENERGY: 218 20165.9157 19540.0890 5761.2415 184.9927 -333856.1146 21546.6560 0.0000 0.0000 44178.6837 -222478.5359 160.7099 -266657.2196 -222068.8153 160.7099 -2628.0652 -2703.9746 921491.4634 -2628.0652 -2703.9746
ENERGY: 219 19429.8641 19413.3931 5754.3577 187.2447 -334778.0708 21596.8808 0.0000 0.0000 45751.9298 -222644.4006 166.4329 -268396.3304 -222073.1718 166.4329 -4457.7332 -2810.5236 921491.4634 -4457.7332 -2810.5236
TIMING: 220 CPU: 105.31, 0.473411/step Wall: 105.31, 0.473411/step, 0.0368208 hours remaining, 3223.472656 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: 114.77, 0.472999/step Wall: 114.77, 0.472999/step, 0.034161 hours remaining, 3223.472656 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 22110.7716 20111.8209 5758.5348 169.0441 -335904.8198 21831.0568 0.0000 0.0000 43526.8719 -222396.7196 158.3388 -265923.5915 -222063.5736 158.3388 -4623.1689 -2633.0913 921491.4634 -4623.1689 -2633.0913
ENERGY: 243 19462.3620 19969.6446 5749.3614 168.8705 -335233.7069 21770.4749 0.0000 0.0000 45537.0690 -222575.9246 165.6513 -268112.9935 -222061.6674 165.6513 -3760.4505 -2614.6992 921491.4634 -3760.4505 -2614.6992
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ENERGY: 246 20878.5481 19853.7025 5716.8932 174.1558 -334213.1206 21705.0851 0.0000 0.0000 43600.4181 -222284.3178 158.6063 -265884.7359 -222067.4296 158.6063 -1173.7929 -2523.3912 921491.4634 -1173.7929 -2523.3912
ENERGY: 247 19868.5287 19979.6440 5712.7400 177.5412 -334802.1842 21719.8455 0.0000 0.0000 44912.1911 -222431.6937 163.3782 -267343.8848 -222068.1394 163.3782 -983.0000 -2552.5930 921491.4634 -983.0000 -2552.5930
ENERGY: 248 19035.4925 20164.4296 5713.8450 181.3144 -335623.1354 21746.4311 0.0000 0.0000 46185.9362 -222595.6866 168.0117 -268781.6228 -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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TIMING: 260 CPU: 124.221, 0.472545/step Wall: 124.221, 0.472545/step, 0.031503 hours remaining, 3223.902344 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 20140.5624 5703.8103 187.9445 -335614.9716 21924.4741 0.0000 0.0000 45349.7771 -222527.2805 164.9700 -267877.0576 -222051.1548 164.9700 -2647.8115 -2773.3903 921491.4634 -2647.8115 -2773.3903
ENERGY: 264 19385.2259 20436.4307 5710.6950 187.5052 -334855.9514 21907.7773 0.0000 0.0000 44751.4783 -222476.8390 162.7936 -267228.3173 -222069.1984 162.7936 -2191.1926 -2723.5293 921491.4634 -2191.1926 -2723.5293
ENERGY: 265 19946.8415 20681.9927 5713.6241 187.4392 -334395.6634 21906.0164 0.0000 0.0000 43607.6373 -222352.1122 158.6326 -265959.7495 -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 -2130.7240 -2664.5956 921491.4634 -2130.7240 -2664.5956
ENERGY: 267 19648.0906 20691.2677 5707.0583 187.8501 -334831.4857 21930.8375 0.0000 0.0000 44220.2168 -222446.1647 160.8610 -266666.3815 -222055.6586 160.8610 -2435.4234 -2662.6783 921491.4634 -2435.4234 -2662.6783
ENERGY: 268 19962.9160 20375.7514 5700.1930 187.9286 -335513.7449 21959.1258 0.0000 0.0000 44823.5377 -222504.2924 163.0557 -267327.8301 -222075.9874 163.0557 -2903.2124 -2658.6180 921491.4634 -2903.2124 -2658.6180
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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 22620.1934 19450.9165 5690.3173 187.1618 -336650.6773 22028.8071 0.0000 0.0000 44308.0074 -222365.2737 161.1804 -266673.2812 -222067.0434 161.1804 -3583.3633 -2617.7582 921491.4634 -3583.3633 -2617.7582
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ENERGY: 272 21021.5584 18896.0660 5692.8269 184.9335 -335921.4613 22015.0580 0.0000 0.0000 45607.7075 -222503.3110 165.9083 -268111.0186 -222081.1572 165.9083 -2551.9683 -2501.8804 921491.4634 -2551.9683 -2501.8804
ENERGY: 273 20123.2135 18932.9079 5697.5118 183.8526 -334925.7011 21985.5296 0.0000 0.0000 45502.7161 -222499.9696 165.5264 -268002.6857 -222069.0459 165.5264 -1837.1975 -2434.6760 921491.4634 -1837.1975 -2434.6760
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ENERGY: 276 19401.8503 19594.7507 5701.2547 182.4904 -333292.1282 21971.0410 0.0000 0.0000 44028.5272 -222412.2139 160.1637 -266440.7411 -222072.9394 160.1637 -1580.1300 -2417.6040 921491.4634 -1580.1300 -2417.6040
ENERGY: 277 19149.2973 19724.7159 5695.5210 182.9396 -333864.3455 21997.2387 0.0000 0.0000 44632.8113 -222481.8217 162.3619 -267114.6330 -222061.0987 162.3619 -2311.7545 -2498.0545 921491.4634 -2311.7545 -2498.0545
ENERGY: 278 20199.4577 19713.7760 5686.9122 183.6585 -334821.1005 22041.3359 0.0000 0.0000 44532.2542 -222463.7060 161.9961 -266995.9603 -222063.4130 161.9961 -3254.8156 -2593.7697 921491.4634 -3254.8156 -2593.7697
ENERGY: 279 21984.3649 19593.9432 5677.5176 184.5187 -335888.5803 22096.4199 0.0000 0.0000 43975.0882 -222376.7278 159.9693 -266351.8160 -222065.2022 159.9693 -4044.3213 -2682.8389 921491.4634 -4044.3213 -2682.8389
TIMING: 280 CPU: 133.657, 0.471822/step Wall: 133.657, 0.471822/step, 0.0288336 hours remaining, 3223.902344 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: 282 20943.7899 19615.5381 5669.9796 186.8360 -336942.5037 22176.7655 0.0000 0.0000 45823.3370 -222526.2577 166.6927 -268349.5947 -222063.3315 166.6927 -2992.3272 -2779.3669 921491.4634 -2992.3272 -2779.3669
ENERGY: 283 20432.1061 19966.6616 5678.8137 187.1634 -336251.9204 22171.0649 0.0000 0.0000 45328.8521 -222487.2586 164.8939 -267816.1107 -222060.8459 164.8939 -2008.7737 -2748.2307 921491.4634 -2008.7737 -2748.2307
ENERGY: 284 20506.3999 20401.8822 5692.0830 187.1346 -335412.6302 22166.2910 0.0000 0.0000 44071.4481 -222387.3914 160.3198 -266458.8395 -222061.5540 160.3198 -1267.2792 -2712.3903 921491.4634 -1267.2792 -2712.3903
ENERGY: 285 20203.3288 20789.9628 5707.3565 186.7145 -334827.1967 22167.0166 0.0000 0.0000 43418.2631 -222354.5545 157.9437 -265772.8176 -222053.5966 157.9437 -1010.8439 -2700.0821 921491.4634 -1010.8439 -2700.0821
ENERGY: 286 19396.6310 20966.5621 5721.5031 185.8230 -334658.1149 22176.6863 0.0000 0.0000 43785.6882 -222425.2212 159.2803 -266210.9094 -222054.0582 159.2803 -1306.7503 -2717.2848 921491.4634 -1306.7503 -2717.2848
ENERGY: 287 19176.1190 20856.7821 5731.9346 184.4714 -334918.1479 22200.2910 0.0000 0.0000 44282.9438 -222485.6059 161.0892 -266768.5497 -222055.7253 161.0892 -2148.9613 -2753.3345 921491.4634 -2148.9613 -2753.3345
ENERGY: 288 20263.2088 20475.2849 5736.9557 182.7335 -335468.3145 22237.9037 0.0000 0.0000 44116.9905 -222455.2374 160.4855 -266572.2279 -222066.9051 160.4855 -3310.5879 -2790.1553 921491.4634 -3310.5879 -2790.1553
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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 ============== 149.396
LDB: Largest compute 200 load 0.523339 is 1.1% of average load 45.861419
LDB: Average compute 0.064255 is 0.1% of average load 45.861419
LDB: TIME 149.398 LOAD: AVG 45.8614 MAX 47.263 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3224.32 MB
LDB: TIME 149.399 LOAD: AVG 45.8614 MAX 47.263 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 RefineTorusLB MEM: 3224.32 MB
LDB: TIME 149.412 LOAD: AVG 45.8614 MAX 46.385 PROXIES: TOTAL 114 MAXPE 30 MAXPATCH 2 RefineTorusLB MEM: 3224.32 MB
LDB: ============== END OF LOAD BALANCING =============== 149.413
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 149.414
Info: Initial time: 4 CPUs 0.472281 s/step 5.46621 days/ns 3224.32 MB memory
TIMING: 300 CPU: 143.088, 0.471551/step Wall: 143.088, 0.471551/step, 0.0261973 hours remaining, 3224.316406 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: 152.343, 0.46272/step Wall: 152.343, 0.46272/step, 0.023136 hours remaining, 3224.316406 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: 161.592, 0.46247/step Wall: 161.592, 0.46247/step, 0.0205542 hours remaining, 3224.316406 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: 170.834, 0.4621/step Wall: 170.834, 0.4621/step, 0.0179706 hours remaining, 3224.316406 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: 364 19323.8976 19612.6012 5699.8913 181.0103 -336175.1995 22790.5191 0.0000 0.0000 46034.3491 -222532.9309 167.4603 -268567.2800 -222068.5914 167.4603 -1420.0425 -2476.3756 921491.4634 -1420.0425 -2476.3756
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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: 377 20646.4609 20251.1593 5706.5522 182.3249 -335763.5804 22794.3774 0.0000 0.0000 43848.2755 -222334.4302 159.5080 -266182.7058 -222041.4013 159.5080 -1819.5858 -2472.4986 921491.4634 -1819.5858 -2472.4986
ENERGY: 378 20473.8100 20495.6595 5711.4639 183.2952 -336584.2281 22821.5838 0.0000 0.0000 44474.7537 -222423.6621 161.7869 -266898.4158 -222044.3967 161.7869 -2972.9873 -2523.3498 921491.4634 -2972.9873 -2523.3498
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TIMING: 380 CPU: 180.073, 0.461918/step Wall: 180.073, 0.461918/step, 0.0153973 hours remaining, 3224.316406 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: 383 21263.6993 19910.9243 5714.6670 180.7420 -337128.0229 22911.2848 0.0000 0.0000 44707.9444 -222438.7612 162.6352 -267146.7056 -222048.1881 162.6352 -2023.0801 -2294.0131 921491.4634 -2023.0801 -2294.0131
ENERGY: 384 19625.4113 19596.0351 5710.5349 179.0647 -336052.0487 22884.2537 0.0000 0.0000 45539.1833 -222517.5657 165.6590 -268056.7490 -222062.0924 165.6590 -569.2377 -2166.9356 921491.4634 -569.2377 -2166.9356
ENERGY: 385 19327.8180 19356.8909 5707.7752 177.4354 -335210.6402 22871.6147 0.0000 0.0000 45299.7172 -222469.3888 164.7879 -267769.1060 -222051.0992 164.7879 215.3517 -2064.3634 921491.4634 215.3517 -2064.3634
ENERGY: 386 19981.2273 19220.9462 5707.6638 175.9384 -334865.1819 22880.7961 0.0000 0.0000 44519.8587 -222378.7514 161.9510 -266898.6101 -222051.0436 161.9510 122.6671 -2011.2426 921491.4634 122.6671 -2011.2426
ENERGY: 387 20367.2861 19202.4843 5710.9354 174.6759 -335109.8728 22905.2747 0.0000 0.0000 44377.1816 -222372.0348 161.4320 -266749.2164 -222053.0049 161.4320 -738.9583 -2019.1687 921491.4634 -738.9583 -2019.1687
ENERGY: 388 20282.3988 19280.0167 5717.2935 173.7038 -335824.1522 22938.2904 0.0000 0.0000 44972.7761 -222459.6730 163.5986 -267432.4491 -222067.4816 163.5986 -2063.8552 -2076.2819 921491.4634 -2063.8552 -2076.2819
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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 19906.7785 20200.7712 5721.4919 176.2273 -336102.8183 22990.0379 0.0000 0.0000 44712.8676 -222394.6438 162.6531 -267107.5115 -222042.6597 162.6531 -376.0862 -2327.2101 921491.4634 -376.0862 -2327.2101
ENERGY: 398 19692.8117 20133.3592 5716.9814 176.0456 -336812.3385 23014.0590 0.0000 0.0000 45592.7323 -222486.3493 165.8538 -268079.0816 -222045.7219 165.8538 -1710.2236 -2443.6964 921491.4634 -1710.2236 -2443.6964
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LDB: ============= START OF LOAD BALANCING ============== 195.64
LDB: Largest compute 230 load 0.533159 is 1.2% of average load 45.820776
LDB: Average compute 0.064178 is 0.1% of average load 45.820776
LDB: TIME 195.641 LOAD: AVG 45.8208 MAX 46.2255 PROXIES: TOTAL 112 MAXPE 28 MAXPATCH 1 None MEM: 3224.32 MB
LDB: TIME 195.642 LOAD: AVG 45.8208 MAX 46.2255 PROXIES: TOTAL 114 MAXPE 30 MAXPATCH 2 RefineTorusLB MEM: 3224.32 MB
LDB: TIME 195.642 LOAD: AVG 45.8208 MAX 46.2255 PROXIES: TOTAL 114 MAXPE 30 MAXPATCH 2 RefineTorusLB MEM: 3224.32 MB
LDB: ============== END OF LOAD BALANCING =============== 195.643
Info: useSync: 1 useProxySync: 0
LDB: =============== DONE WITH MIGRATION ================ 195.644
Info: Benchmark time: 4 CPUs 0.462195 s/step 5.34948 days/ns 3224.32 MB memory
TIMING: 400 CPU: 189.312, 0.461971/step Wall: 189.312, 0.461971/step, 0.0128325 hours remaining, 3224.316406 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 19835.9105 5715.8942 173.8391 -338107.6285 23109.6383 0.0000 0.0000 44436.8096 -222391.4887 161.6489 -266828.2983 -222049.2223 161.6489 -4939.3793 -2681.7023 921491.4634 -4939.3793 -2681.7023
ENERGY: 403 20784.9695 19778.4825 5715.7218 174.2695 -337239.9781 23077.8407 0.0000 0.0000 45225.5960 -222483.0981 164.5183 -267708.6941 -222046.6851 164.5183 -3613.5976 -2605.7426 921491.4634 -3613.5976 -2605.7426
ENERGY: 404 19687.5953 19735.4025 5713.8114 175.5084 -336169.1142 23038.2905 0.0000 0.0000 45313.8390 -222504.6671 164.8393 -267818.5060 -222060.2373 164.8393 -1967.0746 -2494.0439 921491.4634 -1967.0746 -2494.0439
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ENERGY: 408 19735.8471 19387.6644 5692.2152 187.5226 -335902.8217 23017.8178 0.0000 0.0000 45394.4116 -222487.3430 165.1324 -267881.7546 -222063.5309 165.1324 -920.8281 -2294.1554 921491.4634 -920.8281 -2294.1554
ENERGY: 409 20350.1188 19376.4608 5688.4775 191.1593 -336896.6846 23057.9927 0.0000 0.0000 45733.6053 -222498.8702 166.3663 -268232.4755 -222051.6703 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
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ENERGY: 413 21130.1418 20138.5249 5699.9334 199.7191 -337872.5319 23125.1120 0.0000 0.0000 45113.2140 -222465.8867 164.1095 -267579.1007 -222055.3451 164.1095 -3850.6267 -2398.9548 921491.4634 -3850.6267 -2398.9548
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ENERGY: 415 19745.2666 20572.1259 5708.7452 198.1487 -336456.1972 23071.1994 0.0000 0.0000 44733.2271 -222427.4843 162.7272 -267160.7114 -222049.0344 162.7272 -1174.6451 -2266.5614 921491.4634 -1174.6451 -2266.5614
ENERGY: 416 19942.3170 20661.9896 5710.0857 195.6953 -336157.5862 23063.1717 0.0000 0.0000 44200.2848 -222384.0420 160.7885 -266584.3269 -222052.9643 160.7885 -282.7613 -2224.6896 921491.4634 -282.7613 -2224.6896
ENERGY: 417 20031.3750 20631.3208 5709.0494 192.4696 -336373.1075 23072.1100 0.0000 0.0000 44338.4618 -222398.3208 161.2911 -266736.7827 -222044.6992 161.2911 -112.4553 -2227.1699 921491.4634 -112.4553 -2227.1699
ENERGY: 418 20154.6649 20457.0907 5705.5848 188.6536 -336970.7867 23098.6727 0.0000 0.0000 44915.1423 -222450.9777 163.3889 -267366.1200 -222046.7092 163.3889 -671.8547 -2269.9921 921491.4634 -671.8547 -2269.9921
ENERGY: 419 20790.7632 20185.5521 5700.4811 184.6054 -337717.8756 23139.8024 0.0000 0.0000 45250.3102 -222466.3612 164.6082 -267716.6715 -222049.5949 164.6082 -1783.9423 -2336.6465 921491.4634 -1783.9423 -2336.6465
TIMING: 420 CPU: 198.524, 0.460605/step Wall: 198.524, 0.460605/step, 0.0102357 hours remaining, 3224.316406 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: 426 19603.3347 19432.3069 5702.4947 169.0990 -335270.6874 23080.2889 0.0000 0.0000 44862.7389 -222420.4243 163.1983 -267283.1632 -222049.1086 163.1983 -1125.8051 -2237.7215 921491.4634 -1125.8051 -2237.7215
ENERGY: 427 19598.5316 19595.2899 5707.1504 168.7509 -335498.4318 23074.5003 0.0000 0.0000 44915.2779 -222438.9307 163.3894 -267354.2086 -222048.7335 163.3894 -741.9010 -2207.6356 921491.4634 -741.9010 -2207.6356
ENERGY: 428 20140.4229 19760.4171 5710.4629 168.5259 -336199.9853 23087.7673 0.0000 0.0000 44884.2598 -222448.1294 163.2766 -267332.3893 -222058.0547 163.2766 -935.5733 -2206.9586 921491.4634 -935.5733 -2206.9586
ENERGY: 429 21147.3677 19912.0619 5712.1358 168.3557 -337181.5907 23116.4517 0.0000 0.0000 44706.5248 -222418.6932 162.6300 -267125.2180 -222045.4879 162.6300 -1630.8086 -2233.4563 921491.4634 -1630.8086 -2233.4563
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 430 22013.9873 20024.3737 5712.1700 168.1897 -338096.9204 23149.4489 0.0000 0.0000 44626.3103 -222402.4404 162.3383 -267028.7507 -222047.3913 162.3383 -2472.2458 -2268.0466 921491.4634 -2472.2458 -2268.0466
ENERGY: 431 22204.1022 20111.4153 5711.2600 168.0704 -338644.7643 23172.3800 0.0000 0.0000 44858.4633 -222419.0730 163.1828 -267277.5363 -222048.7167 163.1828 -3116.2807 -2293.5593 921491.4634 -3116.2807 -2293.5593
ENERGY: 432 21768.3704 20188.6724 5710.3547 168.1086 -338651.2103 23176.0842 0.0000 0.0000 45177.9913 -222461.6287 164.3451 -267639.6200 -222065.9060 164.3451 -3350.2745 -2296.1500 921491.4634 -3350.2745 -2296.1500
ENERGY: 433 21200.9072 20275.9664 5710.3763 168.4633 -338164.0638 23162.2906 0.0000 0.0000 45192.9287 -222453.1313 164.3995 -267646.0600 -222052.5984 164.3995 -3187.3736 -2272.1278 921491.4634 -3187.3736 -2272.1278
ENERGY: 434 20730.3412 20338.1499 5711.6061 169.3247 -337394.2703 23140.7731 0.0000 0.0000 44883.1000 -222420.9753 163.2724 -267304.0753 -222051.1464 163.2724 -2694.3110 -2227.7887 921491.4634 -2694.3110 -2227.7887
ENERGY: 435 20235.2200 20362.4014 5714.0003 170.8455 -336680.6553 23123.4093 0.0000 0.0000 44675.9841 -222398.7946 162.5190 -267074.7787 -222049.5891 162.5190 -2061.3584 -2179.8953 921491.4634 -2061.3584 -2179.8953
ENERGY: 436 19670.9242 20349.9980 5717.2345 173.0864 -336303.8807 23119.9074 0.0000 0.0000 44847.0984 -222425.6316 163.1414 -267272.7300 -222059.6958 163.1414 -1520.6598 -2145.1617 921491.4634 -1520.6598 -2145.1617
ENERGY: 437 19434.5516 20329.5091 5720.9894 175.9827 -336411.9779 23136.3865 0.0000 0.0000 45159.2687 -222455.2900 164.2770 -267614.5587 -222050.7502 164.2770 -1319.1169 -2134.4849 921491.4634 -1319.1169 -2134.4849
ENERGY: 438 19935.1533 20278.6093 5724.6884 179.3848 -336899.4570 23173.5516 0.0000 0.0000 45148.1323 -222459.9372 164.2365 -267608.0696 -222051.5667 164.2365 -1493.0941 -2145.0881 921491.4634 -1493.0941 -2145.0881
ENERGY: 439 21052.7407 20184.4294 5727.7929 183.0561 -337561.7712 23224.7479 0.0000 0.0000 44760.8210 -222428.1832 162.8276 -267189.0041 -222052.7964 162.8276 -1936.1988 -2169.8747 921491.4634 -1936.1988 -2169.8747
TIMING: 440 CPU: 207.73, 0.460304/step Wall: 207.73, 0.460304/step, 0.00767173 hours remaining, 3224.316406 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 22071.5684 20036.2369 5729.7527 186.7201 -338123.1795 23276.2483 0.0000 0.0000 44417.5457 -222405.1074 161.5788 -266822.6531 -222059.4768 161.5788 -2408.4611 -2197.9670 921491.4634 -2408.4611 -2197.9670
ENERGY: 441 22355.5487 19860.0406 5730.3488 190.1145 -338361.1703 23313.2043 0.0000 0.0000 44502.6961 -222409.2174 161.8886 -266911.9135 -222050.0855 161.8886 -2716.1026 -2221.5312 921491.4634 -2716.1026 -2221.5312
ENERGY: 442 21853.6118 19664.5347 5729.4854 192.9411 -338090.1521 23327.1566 0.0000 0.0000 44880.6316 -222441.7909 163.2634 -267322.4224 -222049.7750 163.2634 -2710.5575 -2229.0695 921491.4634 -2710.5575 -2229.0695
ENERGY: 443 21064.3316 19487.0721 5727.6165 194.9329 -337369.3138 23320.0156 0.0000 0.0000 45118.1102 -222457.2349 164.1273 -267575.3452 -222048.5991 164.1273 -2448.1648 -2220.3529 921491.4634 -2448.1648 -2220.3529
ENERGY: 444 20449.3363 19357.2689 5725.4095 195.8735 -336464.1918 23301.5274 0.0000 0.0000 44987.7172 -222447.0590 163.6530 -267434.7762 -222057.9799 163.6530 -2090.2100 -2206.4400 921491.4634 -2090.2100 -2206.4400
ENERGY: 445 20125.5608 19307.2517 5723.6513 195.6942 -335759.3911 23283.8137 0.0000 0.0000 44708.7150 -222414.7044 162.6380 -267123.4194 -222046.5430 162.6380 -1846.9627 -2201.6926 921491.4634 -1846.9627 -2201.6926
ENERGY: 446 19947.6805 19324.9006 5722.5430 194.3235 -335494.5707 23276.0449 0.0000 0.0000 44620.2941 -222408.7841 162.3164 -267029.0782 -222046.1623 162.3164 -1800.7518 -2216.7294 921491.4634 -1800.7518 -2216.7294
ENERGY: 447 19914.2849 19416.0211 5722.2107 191.8641 -335769.4401 23282.7457 0.0000 0.0000 44816.5084 -222425.8052 163.0301 -267242.3136 -222046.8345 163.0301 -1993.3112 -2253.0603 921491.4634 -1993.3112 -2253.0603
ENERGY: 448 20187.5922 19583.6802 5722.5764 188.5554 -336503.1798 23303.8903 0.0000 0.0000 45065.6671 -222451.2182 163.9365 -267516.8854 -222059.3478 163.9365 -2372.1877 -2303.7898 921491.4634 -2372.1877 -2303.7898
ENERGY: 449 20877.4060 19832.6988 5723.5712 184.8596 -337500.9070 23334.5922 0.0000 0.0000 45101.1676 -222446.6116 164.0657 -267547.7792 -222047.7096 164.0657 -2827.1079 -2356.1406 921491.4634 -2827.1079 -2356.1406
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 450 21754.4854 20108.1302 5724.4776 181.0897 -338419.3249 23364.6242 0.0000 0.0000 44854.3095 -222432.2083 163.1677 -267286.5179 -222048.7858 163.1677 -3116.6755 -2394.3896 921491.4634 -3116.6755 -2394.3896
ENERGY: 451 22355.5903 20357.7257 5724.7144 177.6517 -338952.0909 23381.8006 0.0000 0.0000 44542.6986 -222411.9097 162.0341 -266954.6083 -222048.8243 162.0341 -3074.2532 -2405.7797 921491.4634 -3074.2532 -2405.7797
ENERGY: 452 22246.2016 20536.0135 5723.8953 174.8859 -338927.1539 23378.0942 0.0000 0.0000 44452.9196 -222415.1437 161.7075 -266868.0633 -222059.6368 161.7075 -2659.9606 -2384.7568 921491.4634 -2659.9606 -2384.7568
ENERGY: 453 21399.8728 20641.1311 5722.2878 173.1350 -338392.7936 23354.5906 0.0000 0.0000 44683.7035 -222418.0728 162.5470 -267101.7762 -222043.5369 162.5470 -2048.3339 -2342.4668 921491.4634 -2048.3339 -2342.4668
ENERGY: 454 20248.3383 20654.1373 5720.2217 172.3637 -337567.1416 23320.6901 0.0000 0.0000 45008.1467 -222443.2439 163.7273 -267451.3906 -222041.8389 163.7273 -1453.4580 -2293.1450 921491.4634 -1453.4580 -2293.1450
ENERGY: 455 19486.7909 20584.7118 5718.4844 172.5169 -336790.6453 23290.4023 0.0000 0.0000 45086.5790 -222451.1601 164.0126 -267537.7391 -222040.8568 164.0126 -1151.8825 -2255.8571 921491.4634 -1151.8825 -2255.8571
ENERGY: 456 19493.3724 20440.6797 5717.7556 173.4248 -336350.1077 23274.9631 0.0000 0.0000 44811.4727 -222438.4394 163.0118 -267249.9121 -222055.3484 163.0118 -1305.5004 -2245.5822 921491.4634 -1305.5004 -2245.5822
ENERGY: 457 20047.4930 20251.9431 5718.5580 174.9241 -336395.8164 23277.8274 0.0000 0.0000 44521.8707 -222403.2001 161.9583 -266925.0708 -222049.4131 161.9583 -1906.4164 -2263.5012 921491.4634 -1906.4164 -2263.5012
ENERGY: 458 20585.8435 20019.2719 5720.7060 176.6081 -336835.0957 23294.7172 0.0000 0.0000 44632.7892 -222405.1598 162.3618 -267037.9489 -222051.2821 162.3618 -2684.6986 -2301.0426 921491.4634 -2684.6986 -2301.0426
ENERGY: 459 20903.4946 19784.9687 5724.0021 178.1984 -337468.1641 23318.6983 0.0000 0.0000 45113.9370 -222444.8651 164.1121 -267558.8021 -222053.1410 164.1121 -3350.5830 -2341.5796 921491.4634 -3350.5830 -2341.5796
TIMING: 460 CPU: 216.932, 0.460072/step Wall: 216.932, 0.460072/step, 0.00511192 hours remaining, 3224.316406 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: 460 21262.6140 19597.9061 5728.0971 179.4910 -338014.3766 23341.8001 0.0000 0.0000 45423.8568 -222480.6115 165.2395 -267904.4682 -222064.6834 165.2395 -3669.8200 -2365.2412 921491.4634 -3669.8200 -2365.2412
ENERGY: 461 21862.8764 19507.1074 5732.5752 180.4333 -338251.6215 23355.3935 0.0000 0.0000 45154.6139 -222458.6218 164.2601 -267613.2357 -222058.0505 164.2601 -3556.1665 -2361.1799 921491.4634 -3556.1665 -2361.1799
ENERGY: 462 22264.2257 19487.8108 5736.4822 180.9531 -337988.7170 23351.1086 0.0000 0.0000 44559.9292 -222408.2073 162.0968 -266968.1365 -222056.7212 162.0968 -2954.8200 -2323.4250 921491.4634 -2954.8200 -2323.4250
ENERGY: 463 21821.1793 19513.9016 5738.9361 181.1160 -337284.1029 23326.9478 0.0000 0.0000 44313.4571 -222388.5651 161.2002 -266702.0222 -222054.6240 161.2002 -2012.4425 -2264.0778 921491.4634 -2012.4425 -2264.0778
ENERGY: 464 20535.2461 19559.9273 5739.2518 181.0096 -336389.3839 23291.1942 0.0000 0.0000 44654.0267 -222428.7282 162.4391 -267082.7549 -222058.5726 162.4391 -1050.9227 -2205.5267 921491.4634 -1050.9227 -2205.5267
ENERGY: 465 19322.7828 19631.8855 5737.2898 180.7155 -335701.1533 23259.7392 0.0000 0.0000 45094.5687 -222474.1717 164.0416 -267568.7404 -222052.9385 164.0416 -512.3346 -2174.4007 921491.4634 -512.3346 -2174.4007
ENERGY: 466 19088.4512 19708.3583 5733.2107 180.2808 -335443.7725 23245.0605 0.0000 0.0000 45020.7906 -222467.6204 163.7733 -267488.4110 -222052.9783 163.7733 -630.3313 -2182.6709 921491.4634 -630.3313 -2182.6709
ENERGY: 467 19841.8070 19783.1744 5727.6703 179.7757 -335721.0950 23249.4531 0.0000 0.0000 44523.6663 -222415.5480 161.9649 -266939.2143 -222054.3492 161.9649 -1393.6028 -2232.5922 921491.4634 -1393.6028 -2232.5922
ENERGY: 468 20761.8482 19845.4944 5721.5089 179.2779 -336451.5667 23265.8127 0.0000 0.0000 44291.6583 -222385.9663 161.1209 -266677.6246 -222056.3590 161.1209 -2508.6713 -2314.1340 921491.4634 -2508.6713 -2314.1340
ENERGY: 469 21236.3016 19910.2023 5715.6824 178.8504 -337458.3202 23284.3964 0.0000 0.0000 44720.3201 -222412.5672 162.6802 -267132.8873 -222046.0749 162.6802 -3596.7404 -2405.7972 921491.4634 -3596.7404 -2405.7972
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 19972.8935 5710.9491 178.5947 -338383.2508 23297.0675 0.0000 0.0000 45346.4573 -222466.1156 164.9579 -267812.5729 -222047.6088 164.9579 -4259.6994 -2477.6831 921491.4634 -4259.6994 -2477.6831
ENERGY: 471 21732.8678 20054.6835 5707.9626 178.5890 -338913.2453 23297.5088 0.0000 0.0000 45471.3366 -222470.2970 165.4122 -267941.6336 -222047.5359 165.4122 -4290.5682 -2504.3175 921491.4634 -4290.5682 -2504.3175
ENERGY: 472 22081.2361 20161.5550 5707.0091 178.9047 -338870.6769 23279.4494 0.0000 0.0000 45028.5297 -222433.9929 163.8014 -267462.5226 -222059.5058 163.8014 -3659.7360 -2479.9183 921491.4634 -3659.7360 -2479.9183
ENERGY: 473 21866.1363 20289.3423 5707.9843 179.6165 -338307.7194 23240.7367 0.0000 0.0000 44634.5174 -222389.3859 162.3681 -267023.9033 -222043.8539 162.3681 -2556.3616 -2408.1657 921491.4634 -2556.3616 -2408.1657
ENERGY: 474 20842.9706 20372.0983 5710.2160 180.7467 -337438.4556 23189.2352 0.0000 0.0000 44733.2308 -222409.9581 162.7272 -267143.1889 -222041.2619 162.7272 -1295.5525 -2316.2728 921491.4634 -1295.5525 -2316.2728
ENERGY: 475 19674.2082 20371.7670 5712.9876 182.2512 -336604.2317 23142.3822 0.0000 0.0000 45070.2139 -222450.4216 163.9531 -267520.6355 -222039.4529 163.9531 -344.6450 -2232.2125 921491.4634 -344.6450 -2232.2125
ENERGY: 476 19235.7863 20282.0271 5715.7683 184.0125 -336100.0904 23115.8471 0.0000 0.0000 45106.0634 -222460.5858 164.0835 -267566.6492 -222053.6134 164.0835 -92.4049 -2183.0651 921491.4634 -92.4049 -2183.0651
ENERGY: 477 19704.7249 20145.9810 5718.4976 185.9231 -336101.8790 23114.2944 0.0000 0.0000 44812.3209 -222420.1371 163.0149 -267232.4581 -222044.8408 163.0149 -667.4944 -2171.8226 921491.4634 -667.4944 -2171.8226
ENERGY: 478 20493.4775 19974.7636 5721.0254 187.7262 -336537.4037 23131.2465 0.0000 0.0000 44627.0334 -222402.1311 162.3409 -267029.1645 -222047.4103 162.3409 -1807.1601 -2198.7954 921491.4634 -1807.1601 -2198.7954
ENERGY: 479 21125.3057 19793.3954 5723.3295 189.2099 -337215.5838 23156.6776 0.0000 0.0000 44802.1578 -222425.5079 162.9779 -267227.6657 -222050.5457 162.9779 -3089.8512 -2246.7915 921491.4634 -3089.8512 -2246.7915
TIMING: 480 CPU: 226.127, 0.459768/step Wall: 226.127, 0.459768/step, 0.00255427 hours remaining, 3224.316406 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 21624.0327 19623.1963 5725.3111 190.1901 -337854.6787 23181.5123 0.0000 0.0000 45051.6815 -222458.7548 163.8856 -267510.4363 -222064.6207 163.8856 -4077.7324 -2291.4890 921491.4634 -4077.7324 -2291.4890
ENERGY: 481 22092.4854 19510.0433 5727.0952 190.6351 -338199.2484 23196.7964 0.0000 0.0000 45041.3369 -222440.8561 163.8480 -267482.1930 -222052.5263 163.8480 -4466.2391 -2305.6731 921491.4634 -4466.2391 -2305.6731
ENERGY: 482 22186.3469 19466.6794 5728.4964 190.3598 -338044.5423 23192.7479 0.0000 0.0000 44865.8522 -222414.0598 163.2096 -267279.9120 -222051.4110 163.2096 -4059.3096 -2278.0614 921491.4634 -4059.3096 -2278.0614
ENERGY: 483 21553.1415 19511.5746 5729.5660 189.3227 -337426.2192 23165.8745 0.0000 0.0000 44861.8972 -222414.8427 163.1953 -267276.7399 -222048.7670 163.1953 -2964.1721 -2216.4115 921491.4634 -2964.1721 -2216.4115
ENERGY: 484 20460.8929 19631.1940 5730.2465 187.5455 -336590.8890 23126.1357 0.0000 0.0000 45003.6034 -222451.2712 163.7107 -267454.8746 -222059.8737 163.7107 -1565.2424 -2143.1848 921491.4634 -1565.2424 -2143.1848
ENERGY: 485 19688.7723 19800.2992 5730.5256 185.2458 -335902.5873 23092.8476 0.0000 0.0000 44955.5727 -222449.3241 163.5360 -267404.8968 -222045.9601 163.5360 -422.1569 -2086.8734 921491.4634 -422.1569 -2086.8734
ENERGY: 486 19602.5428 19954.8177 5729.7198 182.4662 -335612.3574 23080.3813 0.0000 0.0000 44645.9120 -222416.5177 162.4096 -267062.4297 -222044.6755 162.4096 87.3182 -2070.0980 921491.4634 87.3182 -2070.0980
ENERGY: 487 19881.0925 20072.0213 5727.4347 179.4360 -335846.4488 23091.0550 0.0000 0.0000 44503.3498 -222392.0594 161.8910 -266895.4092 -222045.2402 161.8910 -192.2345 -2106.8838 921491.4634 -192.2345 -2106.8838
ENERGY: 488 20125.2098 20156.1361 5723.5441 176.4338 -336552.5461 23118.8622 0.0000 0.0000 44827.0561 -222425.3039 163.0685 -267252.3601 -222057.1937 163.0685 -1145.7532 -2194.6679 921491.4634 -1145.7532 -2194.6679
ENERGY: 489 20526.8872 20236.4608 5718.5749 173.8639 -337540.4664 23156.7316 0.0000 0.0000 45266.1009 -222461.8471 164.6656 -267727.9480 -222045.6084 164.6656 -2511.2402 -2316.7065 921491.4634 -2511.2402 -2316.7065
ETITLE: TS BOND ANGLE DIHED IMPRP ELECT VDW BOUNDARY MISC KINETIC TOTAL TEMP POTENTIAL TOTAL3 TEMPAVG PRESSURE GPRESSURE VOLUME PRESSAVG GPRESSAVG
ENERGY: 490 21410.7490 20292.9020 5712.8912 171.8438 -338458.1370 23196.4883 0.0000 0.0000 45213.5635 -222459.6991 164.4745 -267673.2626 -222048.2206 164.4745 -3823.4036 -2437.4153 921491.4634 -3823.4036 -2437.4153
ENERGY: 491 22430.4640 20312.1358 5707.3795 170.5404 -338984.5803 23226.0943 0.0000 0.0000 44733.0096 -222404.9567 162.7264 -267137.9662 -222049.4636 162.7264 -4629.6932 -2524.6213 921491.4634 -4629.6932 -2524.6213
ENERGY: 492 22612.9548 20289.6808 5702.9944 170.0208 -338937.5825 23232.7212 0.0000 0.0000 44542.1957 -222387.0147 162.0323 -266929.2104 -222060.3857 162.0323 -4606.8522 -2557.4728 921491.4634 -4606.8522 -2557.4728
ENERGY: 493 21558.2191 20260.7372 5700.7779 170.3200 -338358.0642 23214.0543 0.0000 0.0000 45033.8235 -222420.1322 163.8207 -267453.9557 -222046.5897 163.8207 -3796.3818 -2540.0994 921491.4634 -3796.3818 -2540.0994
ENERGY: 494 20068.3370 20225.0260 5700.9806 171.2193 -337454.3843 23183.0802 0.0000 0.0000 45622.2478 -222483.4935 165.9612 -268105.7413 -222044.0864 165.9612 -2500.8992 -2482.1066 921491.4634 -2500.8992 -2482.1066
ENERGY: 495 19383.2466 20186.8300 5703.5926 172.5416 -336566.9893 23159.4632 0.0000 0.0000 45484.1232 -222477.1921 165.4587 -267961.3154 -222041.5559 165.4587 -1249.6836 -2407.3054 921491.4634 -1249.6836 -2407.3054
ENERGY: 496 19722.4834 20130.6472 5708.0350 174.0933 -335998.7162 23154.2642 0.0000 0.0000 44699.5272 -222409.6658 162.6046 -267109.1930 -222049.0668 162.6046 -478.8996 -2343.4749 921491.4634 -478.8996 -2343.4749
ENERGY: 497 20212.6667 20059.9175 5713.4613 175.7242 -335952.5047 23166.3552 0.0000 0.0000 44261.0289 -222363.3509 161.0095 -266624.3798 -222042.7499 161.0095 -421.0230 -2316.7926 921491.4634 -421.0230 -2316.7926
ENERGY: 498 20182.0164 19957.1214 5718.5597 177.2604 -336366.4936 23189.3592 0.0000 0.0000 44728.2534 -222413.9232 162.7091 -267142.1766 -222044.5218 162.7091 -993.4676 -2331.6470 921491.4634 -993.4676 -2331.6470
ENERGY: 499 20158.0679 19847.7307 5722.4090 178.6361 -337058.4827 23219.2410 0.0000 0.0000 45439.2643 -222493.1337 165.2956 -267932.3980 -222047.2061 165.2956 -2020.8684 -2376.3388 921491.4634 -2020.8684 -2376.3388
Info: Benchmark time: 4 CPUs 0.459358 s/step 5.31664 days/ns 3224.32 MB memory
TIMING: 500 CPU: 235.248, 0.456048/step Wall: 235.248, 0.456048/step, 0 hours remaining, 3224.316406 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 20974.8937 19756.6582 5724.4523 179.8271 -337741.4196 23251.1015 0.0000 0.0000 45359.0776 -222495.4091 165.0039 -267854.4867 -222061.0909 165.0039 -3197.5164 -2425.4140 921491.4634 -3197.5164 -2425.4140
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, 3229.930 MB of memory in use
WRITING VELOCITIES TO OUTPUT FILE AT STEP 500
The last velocity output (seq=-2) takes 0.002 seconds, 3229.930 MB of memory in use
====================================================
WallClock: 242.464020 CPUTime: 242.464020 Memory: 3229.929688 MB
[Partition 0][Node 0] End of program
Application 1111994 resources: utime ~952s, stime ~20s, Rss ~127156, inblocks ~66664, outblocks ~71876
Displaying status file:
verified
/scratch/system/bwjenkins/tests/namd/2.10/cle5.2_gnu5.1.0
WALL=242.464020
CPU=242.464020
MEM=3229.929688
total 744
-rwxr-xr-x 1 bwjenkins BW_System 18 Dec 21 02:51 cputime
-rwxr-xr-x 1 bwjenkins BW_System 19 Dec 21 02:51 memory
-rwxr-xr-x 1 bwjenkins BW_System 18 Dec 21 02:51 wallclock
-rwxr-xr-x 1 bwjenkins BW_System 9 Dec 21 02:50 status
-rwxr-xr-x 1 bwjenkins BW_System 189480 Dec 21 02:50 test.log
-rwxr-xr-x 1 bwjenkins BW_System 505299 Dec 21 02:45 build.log
drwxr-xr-x 2 bwjenkins BW_System 4096 Dec 21 02:45 bin
drwxr-xr-x 11 bwjenkins BW_System 4096 Dec 21 02:35 NAMD_2.10_Source
drwxr-xr-x 5 bwjenkins BW_System 4096 Dec 21 02:23 man
drwxr-xr-x 2 bwjenkins BW_System 4096 Dec 21 02:23 include
drwxr-xr-x 4 bwjenkins BW_System 4096 Dec 21 02:23 lib
-rwxr-xr-x 1 bwjenkins BW_System 1987 Dec 21 02:21 build-notes
-rwxr-xr-x 1 bwjenkins BW_System 4016 Dec 21 02:21 rebuild
lrwxrwxrwx 1 bwjenkins BW_System 7 Dec 21 02:21 relink -> rebuild
-rwxr-xr-x 1 bwjenkins BW_System 761 Dec 21 02:21 remodule
-rwxr-xr-x 1 bwjenkins BW_System 2926 Dec 21 02:21 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/jenkins9730176944613988873.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}
