[gmx-users] unconstrained_start vs. continuation in Gromacs 4.5.x manual
mark.abraham at anu.edu.au
Tue Oct 5 03:55:00 CEST 2010
Agreed. Both are equivalent and legal, but I've updated mdp_opt.html, from which the manual is generated.
----- Original Message -----
From: Oliver Stueker <ostueker at gmail.com>
Date: Tuesday, October 5, 2010 10:58
Subject: [gmx-users] unconstrained_start vs. continuation in Gromacs 4.5.x manual
To: Discussion list for GROMACS users <gmx-users at gromacs.org>
> Dear Gromacs Community,
> as I understand the MDP option "continuation" is the new name
> for the
> option "unconstrained_start".
> I think the 4.5 series manual should be updated to mention that fact,
> since it still only mentions "unconstrained_start"
> (at least the html version of gromacs 4.5.1 :
> 4.5.1/share/gromacs/html/online/mdp_opt.html#bond )
> although that name seems to be deprecated since Gromacs 4.0.
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