AMBER Archive (2008)

Subject: Re: AMBER: missing gaff parameters

From: Samuele Giani (sgiani_at_pci.unizh.ch)
Date: Tue Mar 04 2008 - 10:42:03 CST

Dear Ross,

thank you very much for the solution you pointed out! It is exxxactly
what I was looking for, I was misunderstanding the results of the
parmchk command, up to now... Now I have all the parameters I need

Bye, Samuele

Ross Walker wrote:
> Hi Samuele,
>
> Did you run parmchk on the resulting prep file to generate an frcmod file
> and then load this into leap?
>
> See the following tutorial for details:
>
> http://amber.scripps.edu/tutorials/basic/tutorial4/index.htm
>
> All the best
> Ross
>
> /\
> \/
> |\oss Walker
>

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