[gmx-users] pressure coupling for lipid bilayer
Anton Feenstra
feenstra at chem.vu.nl
Thu May 2 10:42:34 CEST 2002
Xavier Periole wrote:
>
> Using a surface tension is often necessary to reproduce the surface area
> (per lipid) determine experimentally for most (if not all) of the known
> lipid bilayers.
Excuse me for maybe stating the obvious (am I missing the point?) but
shouldn't the lipid forcefield parameters be optimized to reproduce
the proper surface area per lipid? It seems terribly ad-hoc to me to
correct a 'faulty' model in this way.
--
Groetjes,
Anton
________ ___________________________________________________________
| | Anton Feenstra |
| . | Dept. of Pharmacochemistry - Free University Amsterdam |
| |---- | De Boelelaan 1083 - 1081 HV Amsterdam - The Netherlands |
| |---- | Tel: +31 20 44 47608 - Fax: +31 20 44 47610 |
| ' __ | Feenstra at chem.vu.nl - http://www.chem.vu.nl/afdelingen/FAR|
| / \ |-----------------------------------------------------------|
| ( ) | Dept. of Biophysical Chemistry - University of Groningen |
| \__/ | Nijenborgh 4 - 9747 AG Groningen - The Netherlands |
| __ | Tel +31 50 363 4327 - Fax +31 50 363 4800 |
| / \ | K.A.Feenstra at chem.rug.nl - http://md.chem.rug.nl/~anton |
| ( ) |-----------------------------------------------------------|
| \__/ | "This Doesn't Suck, It's a Black Hole !" (K.A. Feenstra) |
|________|___________________________________________________________|
More information about the gromacs.org_gmx-users
mailing list