[gmx-users] ligand force field parameters

Daan van Aalten vdava at davapc1.bioch.dundee.ac.uk
Fri Dec 12 12:29:00 CET 2003


Hi

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Daan

On Fri, 12 Dec 2003, Metpally Raghu Prasad Rao wrote:

> dear gmx-users,
> thanks
> 1. is there any resource(s) where i can find the force field parameters
> for different ligands
> 2. what are best ways to define such force field parameters that can be
> used along with receptors and membranes.
> 3.suppose if such parameters are not available to one such ligands of
> interest can some suggest me means of generating FF parameters.
> 4. re asking previous question best lipids can be used for GPCR simulation
> studies.
>
> thanks in advance
>
> regards
> raghu
> --
> RAGHU PRASAD RAO, METPALLY
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Dr. Daan van Aalten                    Wellcome Trust CDA Fellow
Wellcome Trust Biocentre, Dow Street   TEL: ++ 44 1382 344979
Div. of Biol.Chem. & Mol.Microbiology  FAX: ++ 44 1382 345764
School of Life Sciences                E-mail: dava at davapc1.bioch.dundee.ac.uk
Univ. of Dundee, Dundee DD1 5EH, UK    WWW: http://davapc1.bioch.dundee.ac.uk

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