[gmx-users] construct the long polymer chain

[Dallas Warren]

For people to provide solutions, you will need to show at least what happens when you use more than six, i.e. the errors you get, structures / topologies that are not correct etc.

Catch ya,

Dr. Dallas Warren
Drug Discovery Biology
Monash Institute of Pharmaceutical Sciences, Monash University
381 Royal Parade, Parkville VIC 3052
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. 


> -----Original Message-----
> From: gmx-users-bounces at gromacs.org [mailto:gmx-users-
> bounces at gromacs.org] On Behalf Of cqgzc
> Sent: Friday, 22 March 2013 1:35 PM
> To: gmx-users at gromacs.org
> Subject: [gmx-users] construct the long polymer chain
> 
> Hi
> I have been following
> http://lists.gromacs.org/pipermail/gmx-users/2009-
> March/040125.html(procedure
> by Justin) to construct the Polyethylene (PE). However, I can only get
> the
> PE with length 6 just like
> CH3-CH2-CH2-CH2-CH2-CH3. Therefore, I want to know how to obtain the
> long
> polymer chain(e.g. length=20) using this method. Any help with my
> appreciate.
> 
> 
> 
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