tin A. Lemkul <[EMAIL PROTECTED]>
Subject: Re: [gmx-users] Fatel error in simulated annealing
To: "Gromacs Users' List"
Date: Monday, 8 September, 2008, 5:00 PM
ravi sharma wrote:
> hi
>
> you have written that in my file there are some t
e = 2 500 1000 1500 2000^M
> annealing_temp = 300 350 400 450 450^M
--- On *Mon, 8/9/08, Justin A. Lemkul /<[EMAIL PROTECTED]>/* wrote:
From: Justin A. Lemkul <[EMAIL PROTECTED]>
Subject: Re: [gmx-users] Fatel error in simulated annealin
, 7/9/08, Justin A. Lemkul /<[EMAIL PROTECTED]>/* wrote:
From: Justin A. Lemkul <[EMAIL PROTECTED]>
Subject: Re: [gmx-users] Fatel error in simulated annealing
To: "Discussion list for GROMACS users"
Date: Sunday, 7 September, 2008, 10:28 PM
You have trail
You have trailing characters in your simulated annealing section:
What shows up for me is:
;simulated annealing
annealing = single^M
annealing_npoints = 5 ^M
annealing_time = 2 500 1000 1500 2000^M
annealing_temp = 300 350 400 450 450^M
Are you transferring between Windows and Linux/Mac/etc. sy
Hello guys,
i am doing a simulation with simulated annealing of a protein which contains
heme inside,
the normal without simulated annealing its running fine but while m writing
simulated annealing in my md.mdp its showing error
Fatal error:
Not enough annealing values: 1 (for 4 groups)
I am at
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