[gmx-users] Can I equilibrate with Parinello-Rahman?
Mark.Abraham at anu.edu.au
Thu Apr 26 16:10:23 CEST 2012
On 26/04/2012 10:47 PM, PAVAN PAYGHAN wrote:
> Dear Mark,
> Thanks a lot for the reply and highlighting the cause of error that I
> was facing.
> Still can it be possible to overcome the same error with the available
Unfortunately you're forcing me to guess the context for this question.
If there was a way to make P-R P-couping stable for equilibration in
general, then it would not have the reputation for being unstable... I
gave my advice about what to do already.
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