[gmx-users] Are the constraint forces included in the forcesoutputed in the
gmx3 at hotmail.com
Fri Jan 5 09:01:15 CET 2007
>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.
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