[gmx-users] Are the constraint forces included in the forcesoutputed in the

[Berk Hess]

>From: "Pu Liu" <puliu45 at hotmail.com>
>Reply-To: Discussion list for GROMACS users <gmx-users at gromacs.org>
>To: gmx-users at gromacs.org
>Subject: [gmx-users] Are the constraint forces included in the 
>forcesoutputed in the trr file? Date: Fri, 05 Jan 2007 00:34:03 +0000
>
>Dear GROMACS list members,
>
>   Could you please tell me if the constraint forces are included in the 
>forces outputed in the trr file, or just used to propagate the system?

Constraint forces are not included.

We should state this somewhere in the manual.

Berk.

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