Re: [gmx-users] editconf and the placement of the center of mass

2007-08-08 Thread Tsjerk Wassenaar
Hi Arneh,

From the help of editconf (editconf -h) you could have seen that it
has no such option. It wouldn't be very hard to add it though...

Cheers,

Tsjerk

On 8/8/07, Arneh Babakhani [EMAIL PROTECTED] wrote:
 Hi,

 In editconf, there's an option -center which allows you to place the
 geometrical center of your molecular at a desired location.

 I was wondering, is there an analogous option for the placement of the
 center of mass of a molecule?

 Thanks,

 Arneh
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Tsjerk A. Wassenaar, Ph.D.
Junior UD (post-doc)
Biomolecular NMR, Bijvoet Center
Utrecht University
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[gmx-users] editconf and the placement of the center of mass

2007-08-07 Thread Arneh Babakhani

Hi,

In editconf, there's an option -center which allows you to place the 
geometrical center of your molecular at a desired location. 

I was wondering, is there an analogous option for the placement of the 
center of mass of a molecule?


Thanks,

Arneh
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