Hello,
Would the following be a reasonable way to implement semiisotropic
pressure coupling, for a 128 DMPC membrane:
; Pressure coupling is on
Pcoupl = berendsen
pcoupltype = semiisotropic
tau_p = 1.0 1.0
compressibility = 4.5e-5 1.0e-30
ref_p = 1.0 1.0
[I'm not asking whether this will produce the right membrane
properties. I know there's some trial & error involved in this. I'm
just wondering if this is one possible way to use pressure].
Thanks,
Arneh
_______________________________________________
gmx-users mailing list gmx-users@gromacs.org
http://www.gromacs.org/mailman/listinfo/gmx-users
Please don't post (un)subscribe requests to the list. Use the
www interface or send it to [EMAIL PROTECTED]
Can't post? Read http://www.gromacs.org/mailing_lists/users.php
