AMBER Archive (2005)

Subject: Re: AMBER: desc NEWRES and blank unit type

From: David A. Case (case_at_scripps.edu)
Date: Fri Feb 11 2005 - 16:24:25 CST

On Wed, Feb 09, 2005, Stern, Julie wrote:

> I've built a new residue. I set the head and the tail to the
> appropriate
> atoms. But when I desc NEWRES, it gives back all the info for head atom,
> tail atom, and contents, but leaves the UNIT name blank. Was there some
> place I was supposed to set the UNIT name? It didn't seem to carry it
> through
> from NEWRES = loadpdb res.pdb. Thanks.

You can issue the LEaP command "set NEWRES name FOO"

where "FOO" is the name you wish to assign to the unit.

...dac

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