Re: [AMBER] mmpbsa error: No data for 0+2 MM BOND 200

From: Jason Swails <jason.swails.gmail.com>
Date: Mon, 1 Feb 2010 23:16:20 -0500

Have you applied all of the relevant bug fixes?

On Mon, Feb 1, 2010 at 8:25 PM, xueqin pang <pangxueqintea.yahoo.com.cn> wrote:
> Hello everyone,
>
> When doing mm-pbsa with my protein-ligand system for a 200 snapshots, I get the error: No data for 0+2 MM BOND 200. But it is alright when calculate a 100 and 130 snapshots. And it is alright with mmgbsa too.
>
> So do you have any suggestions on this problem?
>
> Thanks so much
>
> Xueqin
>
> DICP CAS
>
>
> ___________________________________________________________
> 好玩贺卡等你发,邮箱贺卡全新上线!
> http://card.mail.cn.yahoo.com/
> _______________________________________________
> AMBER mailing list
> AMBER.ambermd.org
> http://lists.ambermd.org/mailman/listinfo/amber
>



-- 
---------------------------------------
Jason M. Swails
Quantum Theory Project,
University of Florida
Ph.D. Graduate Student
352-392-4032
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Mon Feb 01 2010 - 20:30:02 PST
Custom Search