Re: [AMBER] How to convert mdcrd for GROMACS analysis?

From: Lorenzo Gontrani <l.gontrani.caspur.it>
Date: Tue, 28 Feb 2012 10:20:05 +0100

Dear Catherine, the simplest way is to use VMD to convert AMBER mdcrd
or cdf binary trajectories to TRR format using VMD (then the TRR file
can be converted to XTC via GROMACS trjconv).
You need a frame in PDB format to prepare the index file needed by
gromacs analysis programs, use make_ndx.

HTH

Lorenzo

2012/2/28 Catein Catherine <askamber23.hotmail.com>:
>
> Dear Sir/Madam,
> How to convert AMBER's trajectory files (mdcrd) to be read or analysze by GROMACS?
> Best regards,
> CAtherine
> _______________________________________________
> AMBER mailing list
> AMBER.ambermd.org
> http://lists.ambermd.org/mailman/listinfo/amber



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 Lorenzo Gontrani
 Research associate of EDXD group
 University of Rome "La Sapienza"
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 Email l DOT gontrani AT caspur DOT it
 Webpage: http://webcaminiti/gontrani.html
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Received on Tue Feb 28 2012 - 01:30:04 PST
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