[gmx-users] building block-rtp
Anton Feenstra
feenstra at chem.vu.nl
Fri Sep 12 08:56:07 CEST 2003
Lakshmi Padmavathi wrote:
> Dear gromacs users,
>
> i would like make one building block for a abnormal residue (not usual amino
> acid but has aminoacid properties).
>
> so,
> i creatred one building block. i inserted in ffgmx.rtp, ffgmx.hdb and in
> aminoacids.dat.
Do you have a specific reason for using the Gromacs forcefield? It is
generally considered out-dated and the Gromos ff's (ffG43*) are preferred.
--
Groetjes,
Anton
_____________ _______________________________________________________
| | |
| _ _ ___,| K. Anton Feenstra |
| / \ / \'| | | Dept. of Pharmacochem. - Vrije Universiteit Amsterdam |
|( | )| | | De Boelelaan 1083 - 1081 HV Amsterdam - Netherlands |
| \_/ \_/ | | | Tel: +31 20 44 47608 - Fax: +31 20 44 47610 |
| | Feenstra at chem.vu.nl - www.chem.vu.nl/~feenstra/ |
| | "If You See Me Getting High, Knock Me Down" |
| | (Red Hot Chili Peppers) |
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