afsaneh maleki wrote:
Hi,
grompp show the error as below:
ERROR: pressure coupling not enough values (I need 2)
I used ref_p =1. In file.mdp
How to solve this problem?
Without seeing the rest of your pressure coupling settings, I can only assume
that you're using semi-isotropic coupling, and thus, per the manual:
"Pressure coupling which is isotropic in the x and y direction, but different in
the z direction. This can be useful for membrane simulations. 2 values are
needed for x/y and z directions respectively."
-Justin
thanks in advance,
Afsaneh
--
========================================
Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
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