. Your structure
is likely not sufficiently energy-minimized to continue.
-Justin
Regards
--
Sonali Dhindwal
--- On *Mon, 24/5/10, Mark Abraham //* wrote:
From: Mark Abraham
Subject: Re: [gmx-users] simulation crashed because of LINCS error
To: "Discussion list for GROMACS
/5/10, Mark Abraham wrote:
From: Mark Abraham
Subject: Re: [gmx-users] simulation crashed because of LINCS error
To: "Discussion list for GROMACS users"
Date: Monday, 24 May, 2010, 1:00 PM
- Original Message -
From: sonali dhindwal
Date: Monday, May 24, 2010 14:32
Subject:
- Original Message -
From: sonali dhindwal
Date: Monday, May 24, 2010 14:32
Subject: [gmx-users] simulation crashed because of LINCS error
To: Discussion list for GROMACS users
---
| > Hello All,
>
> With regard to my
Hello All,
With regard to my previous post
http://www.mail-archive.com/gmx-users@gromacs.org/msg30557.html
I have done postion restrained energy minimisation using POSRES.itp file
obtained from pdb2gmx. so that there should not be any large change in the
strucutre of the protein.
And after th
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