[gmx-users] Dihedral restraints

Justin Lemkul jalemkul at vt.edu
Thu Jan 10 17:20:39 CET 2019



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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