AMBER Archive (2009)

Subject: Re: [AMBER] load .crd & .top in xleap

From: oguz gurbulak (gurbulakoguz_at_gmail.com)
Date: Sun Sep 13 2009 - 14:20:26 CDT


*Try creating a pdb file using ambpdb ***

*ambpdb -pqr prmtop < inpcrd > pdb***

Then load and *take a look at it again in xleap. Do some modifications and
save it as prmtop , inpcrd .*

Hope this helps!

2009/9/13 <vallespardojl_at_chem.leidenuniv.nl>

> Dear AMBER users,
>
> I´ve almost finished a MD with Sander, and now I want modify a couple of
> things with the xleap editor but, is possible load .crd & .top directly in
> xleap? What is the procedure?
>
> regards,
>
> José Luis
>
>
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