[gmx-users] Force constant for distance restraints

[Berk Hess]

>From: Gaurav Porwal <gauravp at che.iitb.ac.in>
>Reply-To: Discussion list for GROMACS users <gmx-users at gromacs.org>
>To: GROMACS users <gmx-users at gromacs.org>
>Subject: [gmx-users] Force constant for distance restraints
>Date: Thu, 21 Oct 2004 15:45:44 +0530 (IST)
>
>Hi,
>
>Thanks for replying back. I'm very much aware that disre_fc can be used to
>specify a force constant but I thought that there might be some pre-fixed
>value which is used as default if nothing is specified. I presume now
>that's not the case and everytime we specify, say
>
>disre = simple , we will need to give something as disre_fc.
>
>What are the typical values of disre_fc which are used for NMR
>refinements?

Default is 1000, as int the manual.
This is the typical value.

Berk.

_________________________________________________________________
Play online games with your friends with MSN Messenger 
http://messenger.msn.nl/