Code: Select all
[05:46:16] Project: 2671 (Run 47, Clone 24, Gen 72)
[05:46:16]
[05:46:16] Assembly optimizations on if available.
[05:46:16] Entering M.D.
[05:46:26] Run 47, Clone 24, Gen 72)
[05:46:26]
[05:46:26] Entering M.D.
NNODES=4, MYRANK=0, HOSTNAME=NZXT-Quad
NNODES=4, MYRANK=2, HOSTNAME=NZXT-Quad
NNODES=4, MYRANK=3, HOSTNAME=NZXT-Quad
NODEID=2 argc=19
NODEID=3 argc=19
NNODES=4, MYRANK=1, HOSTNAME=NZXT-Quad
NODEID=0 argc=19
:-) G R O M A C S (-:
Groningen Machine for Chemical Simulation
:-) VERSION 3.3.99_development_200800503 (-:
Written by David van der Spoel, Erik Lindahl, Berk Hess, and others.
Copyright (c) 1991-2000, University of Groningen, The Netherlands.
Copyright (c) 2001-2008, The GROMACS development team,
check out http://www.gromacs.org for more information.
:-) mdrun (-:
NODEID=1 argc=19
Reading file work/wudata_03.tpr, VERSION 3.3.99_development_20070618 (single precision)
Note: tpx file_version 48, software version 56
Making 1D domain decomposition 1 x 1 x 4
starting mdrun '22866 system in water'
9000001 steps, 18000.0 ps.
Writing checkpoint, step 9254110 at Sun Feb 1 00:01:35 2009
Writing checkpoint, step 9258220 at Sun Feb 1 00:16:33 2009
Writing checkpoint, step 9262330 at Sun Feb 1 00:31:35 2009
Writing checkpoint, step 9266430 at Sun Feb 1 00:46:34 2009
Writing checkpoint, step 9270540 at Sun Feb 1 01:01:34 2009
Writing checkpoint, step 9274650 at Sun Feb 1 01:16:35 2009
Writing checkpoint, step 9278750 at Sun Feb 1 01:31:34 2009
Writing checkpoint, step 9282860 at Sun Feb 1 01:46:35 2009
Writing checkpoint, step 9286950 at Sun Feb 1 02:01:33 2009
Writing checkpoint, step 9292720 at Sun Feb 1 02:16:33 2009
Writing checkpoint, step 9300900 at Sun Feb 1 02:31:33 2009
Writing checkpoint, step 9309070 at Sun Feb 1 02:46:33 2009
Writing checkpoint, step 9317250 at Sun Feb 1 03:01:34 2009
Writing checkpoint, step 9325420 at Sun Feb 1 03:16:34 2009
Writing checkpoint, step 9332300 at Sun Feb 1 03:31:35 2009
Writing checkpoint, step 9336400 at Sun Feb 1 03:46:33 2009
[09:59:43] )
Writing checkpoint, step 9340520 at Sun Feb 1 04:01:35 2009
Writing checkpoint, step 9344620 at Sun Feb 1 04:16:35 2009
Writing checkpoint, step 9348720 at Sun Feb 1 04:31:35 2009
Writing checkpoint, step 9352820 at Sun Feb 1 04:46:34 2009
Writing checkpoint, step 9356930 at Sun Feb 1 05:01:34 2009
Writing checkpoint, step 9361030 at Sun Feb 1 05:16:34 2009
Writing checkpoint, step 9365120 at Sun Feb 1 05:31:33 2009
Writing checkpoint, step 9369210 at Sun Feb 1 05:46:33 2009
Writing checkpoint, step 9373310 at Sun Feb 1 06:01:33 2009
Writing checkpoint, step 9377420 at Sun Feb 1 06:16:34 2009
Writing checkpoint, step 9381530 at Sun Feb 1 06:31:34 2009
Writing checkpoint, step 9385640 at Sun Feb 1 06:46:35 2009
Writing checkpoint, step 9389730 at Sun Feb 1 07:01:34 2009
Writing checkpoint, step 9393830 at Sun Feb 1 07:16:34 2009
Writing checkpoint, step 9397940 at Sun Feb 1 07:31:35 2009
Writing checkpoint, step 9402020 at Sun Feb 1 07:46:34 2009
Writing checkpoint, step 9405980 at Sun Feb 1 08:01:34 2009
Writing checkpoint, step 9410070 at Sun Feb 1 08:16:35 2009
Writing checkpoint, step 9414160 at Sun Feb 1 08:31:33 2009
Writing checkpoint, step 9418270 at Sun Feb 1 08:46:35 2009
Writing checkpoint, step 9422360 at Sun Feb 1 09:01:33 2009
Writing checkpoint, step 9426470 at Sun Feb 1 09:16:35 2009
[15:29:32] Completed 180009 out of 9000001 steps (2%)
Writing checkpoint, step 9430570 at Sun Feb 1 09:31:35 2009
Writing checkpoint, step 9434660 at Sun Feb 1 09:46:35 2009
Writing checkpoint, step 9438740 at Sun Feb 1 10:01:34 2009
Writing checkpoint, step 9442840 at Sun Feb 1 10:16:35 2009
Writing checkpoint, step 9446930 at Sun Feb 1 10:31:34 2009
Writing checkpoint, step 9451030 at Sun Feb 1 10:46:34 2009
Writing checkpoint, step 9455130 at Sun Feb 1 11:01:33 2009
Writing checkpoint, step 9459240 at Sun Feb 1 11:16:34 2009
Writing checkpoint, step 9463340 at Sun Feb 1 11:31:34 2009
Writing checkpoint, step 9467450 at Sun Feb 1 11:46:34 2009
Writing checkpoint, step 9471550 at Sun Feb 1 12:01:33 2009
Writing checkpoint, step 9475660 at Sun Feb 1 12:16:35 2009
Writing checkpoint, step 9479760 at Sun Feb 1 12:31:34 2009
Writing checkpoint, step 9483860 at Sun Feb 1 12:46:34 2009
Writing checkpoint, step 9487950 at Sun Feb 1 13:01:33 2009
Writing checkpoint, step 9492060 at Sun Feb 1 13:16:33 2009
Writing checkpoint, step 9496160 at Sun Feb 1 13:31:35 2009
Writing checkpoint, step 9500250 at Sun Feb 1 13:46:35 2009
Writing checkpoint, step 9504350 at Sun Feb 1 14:01:33 2009
Writing checkpoint, step 9508460 at Sun Feb 1 14:16:34 2009
Writing checkpoint, step 9512550 at Sun Feb 1 14:31:34 2009
Writing checkpoint, step 9516660 at Sun Feb 1 14:46:34 2009
[20:58:50] Completed 270009 out of 9000001 steps (3%)
Writing checkpoint, step 9520750 at Sun Feb 1 15:01:34 2009
Writing checkpoint, step 9524850 at Sun Feb 1 15:16:34 2009
Writing checkpoint, step 9528950 at Sun Feb 1 15:31:35 2009
Writing checkpoint, step 9533040 at Sun Feb 1 15:46:35 2009
Writing checkpoint, step 9537130 at Sun Feb 1 16:01:33 2009
Code: Select all
[05:46:16] Assembly optimizations on if available.
[05:46:16] Entering M.D.
[05:46:26] Run 47, Clone 24, Gen 72)
[05:46:26]
[05:46:26] Entering M.D.
[09:59:43] )
[15:29:32] Completed 180009 out of 9000001 steps (2%)
[20:58:50] Completed 270009 out of 9000001 steps (3%)