Thank you Andreas!
I installed the ambertools10, now everything is happy and cool ^_^
Eduardo
Andreas Svrcek-Seiler wrote:
> Hi Eduardo,
> I vaguely remember the calling conventions for nmode changed somewhere in
> time. However, crambin.nab works for me (versions from amber10 and
> amber11 being identical. It seems you are still using some old version
> from nab5.x.
> Anyway, if you find a line like
> ier = nmode( x, 3*m.natoms, mme2, 0);
> ...try changing it to
> ier = nmode( x, 3*m.natoms, mme2, 0,0,0.0,0.0,0);
>
> I hope that helps,
> good luck
> Andreas
>
>
> )))))
> (((((
> ( O O )
> -------oOOO--(_)--OOOo-----------------------------------------------------
>
> o Wolfgang Andreas Svrcek-Seiler
> o (godzilla)
> svrci.tbi.univie.ac.at
> .oooO Tel.:01-4277-52747
> ( ) Oooo.
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Received on Mon Jul 06 2009 - 11:06:46 PDT
