[gmx-users] diffusion of the water at the micelle surface

2011-11-27 Thread chris . neale
gromacs. Unfortunately, it is not the case, so i will try your suggestions . Stephane -- Message: 6 Date: Sat, 26 Nov 2011 10:17:10 -0500 From: chris.neale at utoronto.ca Subject: [gmx-users] diffusion of the water at the micelle surface To: gmx-users at gromacs.org

[gmx-users] diffusion of the water at the micelle surface

2011-11-27 Thread ABEL Stephane 175950
this option exist in gromacs. Unfortunately, it is not the case, so i will try your suggestions . Stephane -- Message: 6 Date: Sat, 26 Nov 2011 10:17:10 -0500 From: chris.ne...@utoronto.ca Subject: [gmx-users] diffusion of the water at the micelle surface To: gmx

Re: [gmx-users] diffusion of the water at the micelle surface

2011-11-26 Thread lina
On Sat, Nov 26, 2011 at 11:17 PM, wrote: > When people do this for lipid bilayers, they compute depth-dependent > diffusion profiles (often diffusion is computed separately for lateral > diffusion and diffusion along the bilayer normal). Sounds like you might do > something similar. I doubt that

[gmx-users] diffusion of the water at the micelle surface

2011-11-26 Thread chris . neale
When people do this for lipid bilayers, they compute depth-dependent diffusion profiles (often diffusion is computed separately for lateral diffusion and diffusion along the bilayer normal). Sounds like you might do something similar. I doubt that the standard gromacs tools will do this for