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Re: [lammps-users] (no subject)


From: Axel Kohlmeyer <akohlmey@...24...>
Date: Sat, 26 Aug 2017 10:54:33 -0400



On Sat, Aug 26, 2017 at 1:38 AM, sanchari bhatt <sanchari789byc@...24...> wrote:
hello users!

i am trying two merge two datafiles

anybody has idea how to merge this two shake commands

fix SHAKE all shake 0.0001 20 0 b 5 6 7

fix             RigidOHBonds all shake 0.0001 20 0 b 4 a 4


​look at the fix shake documentation. take note of what each of the two command lines does​ and then write a new command line that does all of those things.

axel.

 





any help appreciated!

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--
Dr. Axel Kohlmeyer  akohlmey@...12...24...  http://goo.gl/1wk0
College of Science & Technology, Temple University, Philadelphia PA, USA
International Centre for Theoretical Physics, Trieste. Italy.