[gmx-users] Dihedral restraints

[Mark Abraham]

Hi,

Or provide feedback to CHARMM-GUI people!

Mark

On Thu., 10 Jan. 2019, 17:22 Justin Lemkul, <jalemkul at vt.edu> wrote:

>
>
> On 1/10/19 10:51 AM, ABEL Stephane wrote:
> > Thank you Mark,
> >
> > With your example, I have finally resolved my problem and finally found
> that the dihedral restraints were not actived in my simulations :((
> >
> > If someone is interested to know how I did for resolving my problem
> especially when you use  the files generated by CHARMM-GUI for GROMACS, do
> not hesitate to contact me directly
>
> Posting directly to the list with your solution would be greatly
> appreciated, so that when someone Googles this same question in the
> future, they will immediately have their answer.
>
> -Justin
>
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> Justin A. Lemkul, Ph.D.
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