Re: [gmx-users] water distortion above bilayer

2008-05-18 Thread Mark Abraham
ANINDITA GAYEN wrote: Hi all, In the TIP4P water layer above my dmpc bilayer after 100ps (OPLS-BERGER) a hole is being formed. Some water molecules are absent in the water layer, but the total no of water molecules are same. This is my semi.mdp file This sounds like normal behaviour under p

[gmx-users] water distortion above bilayer

2008-05-18 Thread ANINDITA GAYEN
Hi all, In the TIP4P water layer above my dmpc bilayer after 100ps (OPLS-BERGER) a hole is being formed. Some water molecules are absent in the water layer, but the total no of water molecules are same. This is my semi.mdp file title = bilayer MD DMPC PURE cpp