AMBER Archive (2009)

Subject: Re: [AMBER] can antechamber convert a prep file from cartesian to internal coordinates?

From: Paul Ledbetter (pjl1_at_rice.edu)
Date: Tue Sep 15 2009 - 18:40:09 CDT

I need the prep file as input to another program which only knows how
to read prep files in internal coordinates. It isn't a big deal for
me to fix the other program to read cartesian coordinates if
antechamber isn't meant to do this.

On Tue, Sep 15, 2009 at 17:15, Bill Ross <ross_at_cgl.ucsf.edu> wrote:
>>   I have an AMBER prep file in cartesian coordinates which I'd like to
>> convert to internal coordinates.
>
> Why?
>
> Bill
>
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