[gmx-users] capped residue
Xavier Periole
x.periole at rug.nl
Wed Jan 19 11:29:58 CET 2005
>If I check at
>/usr/local/share/gromacs/top/ffgmx.rtp
>
>NT atom is there!
>
>
No thje atom there is N of type NT !!!! change the name in the pdb file to N
and it should work ...
XAvier
--
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Xavier Periole - Ph.D.
Dept. of Biophysical Chemistry / MD Group
Univ. of Groningen
Nijenborgh 4
9747 AG Groningen
The Netherlands
Tel: +31-503634329
Fax: +31-503634800
email: x.periole at rug.nl
web-page: http://md.chem.rug.nl/~periole
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