AMBER Archive (2009)

Subject: Re: [AMBER] Creating new residue with tleap.

From: case (case_at_biomaps.rutgers.edu)
Date: Wed Nov 11 2009 - 06:37:47 CST


On Wed, Nov 11, 2009, rrd wrote:
>
> I tried create new residue in tleap, but it didn't work than.

See tutorial B4; you have to create a library (with atom types and charges
and so on). This is saved in prep or mol2 format. Then you load both the
library and the pdb file into LEaP.

....good luck...dac

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