AMBER Archive (2005)

Subject: Re: AMBER: How can I read parm99.dat file?

From: David A. Case (case_at_scripps.edu)
Date: Thu May 05 2005 - 10:10:59 CDT

On Wed, May 04, 2005, Myunggi Yi wrote:
>
> Where can I get information to read the parm99.dat file?
> ===========================================================================
> I 126.9 4.690 iodine (Applequist)
> I -CT 148.0 2.166 Junmei et al,99
> I -CA 171.0 2.075 Junmei et al,99
> I -CA-CA 70.0 118.80 Junmei et al,99
> I -CT-CT 50.0 106.00 Junmei et al,99
> I 2.35 0.40 JCC,7,(1986),230;
> ======================================================================
>
> I know the first line the first colum is mass, and what is the second
> colum and else?

Please see http://amber.scripps.edu/formats.html#parm.dat.

...dac

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