AMBER Archive (2009)

Subject: Re: [AMBER] GAFF and solvents.lib error

• Previous message: CHAMI F.: "[AMBER] radial distribution without normalization"
• In reply to: Vishal Maingi: "[AMBER] GAFF and solvents.lib error"
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On Wed, Jun 10, 2009, Vishal Maingi wrote:
>
>
> also one more thing when I saveamberparm for solvated molecule it is showing message of
>
> could not detect OW
> could not detect HW
> parameter file not saved

You need to load solvents.lib, and probably parm99.dat as well.

...dac

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• Previous message: CHAMI F.: "[AMBER] radial distribution without normalization"
• In reply to: Vishal Maingi: "[AMBER] GAFF and solvents.lib error"
• Messages sorted by: [ date ] [ thread ] [ subject ] [ author ]