AMBER Archive (2008)

Subject: Re: AMBER: How to transfer unformatted coordinates into formatted ones

From: David A. Case (case_at_scripps.edu)
Date: Wed May 07 2008 - 20:14:04 CDT

On Wed, May 07, 2008, Qi Yan wrote:
>
> Does anybody know how to transfer an unformatted coordinate file into
> formatted one?

You can do a 0-step minimization in sander (actually equivalent to a 1-step
minimization), and read in the unformatted file and write out a formatted one.

Haven't tried this, but it should work...good luck...dac

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