[gmx-users] reagarding polarisable force field in gromacs

[Dallas Warren]

What is it exactly that you "don't get"?

 

You need to provide more details and put your question into context.
Then people can give you more directed responses that will help you.
Otherwise it is too open ended.

 

Catch ya,

Dr. Dallas Warren

Medicinal Chemistry and Drug Action

Monash Institute of Pharmaceutical Sciences, Monash University
381 Royal Parade, Parkville VIC 3010
dallas.warren at monash.edu

+61 3 9903 9304
---------------------------------
When the only tool you own is a hammer, every problem begins to resemble
a nail. 

 

From: gmx-users-bounces at gromacs.org
[mailto:gmx-users-bounces at gromacs.org] On Behalf Of sreelakshmi ramesh
Sent: Monday, 20 December 2010 2:58 PM
To: jalemkul at vt.edu; Discussion list for GROMACS users
Subject: Re: [gmx-users] reagarding polarisable force field in gromacs

 

Dear justin ,
                   I read the manual and i didnt get it thats why i
sought the help of people here.i want to know how to use those
polarisable force field.

On Mon, Dec 20, 2010 at 9:15 AM, Justin A. Lemkul <jalemkul at vt.edu>
wrote:



sreelakshmi ramesh wrote:

Dear all,
           can anyone tell me if there  are polarisable force field
available in gromacs.I need to use dang chang force field which is
polarisable force field for my work.I have used classical force fields
before can anyone help me out regaring this.

 

Start by reading the manual.  All of the force fields included in
Gromacs are described.  Polarizability is discussed in section 4.4,
mostly in relation to water models.

-Justin


thanks in advance ,
shree


-- 
========================================

Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin

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