[gmx-users] solvent for dehydratation

[Andrey V Golovin]

Hello Christoph,

Wednesday, July 16, 2003, 1:24:18 PM, you wrote:
>>
CF> Why not just do what you pointed out yourself.
CF> take teh water out and replace it by a non-h-bonding solvent? Isn't
CF> there a box of decane (IIRC) in $GMXDATA/top?

I have only 64 dppc bilayer so the cell is small may be it is better use the
heptane box from http://www.gromacs.org/topologies/molecules.php.



-- 
Best regards,
 Andrey                            mailto:golovin at genebee.msu.su